50108 -OEChem-03292408382D 69 70 0 0 0 0 0 0 0999 V2000 4.3479 -1.7783 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 -3.4519 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2345 -3.1050 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 4.1742 -2.7630 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3631 -1.6046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5216 -0.7935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7968 -3.9519 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4308 -4.3180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4308 -2.5859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6628 1.5481 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 2.6122 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1988 -0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1988 -1.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0648 0.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 0.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7968 1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3327 -1.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 -0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0648 1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5712 0.1405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 1.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0648 -1.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7968 0.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 1.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9284 0.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2552 2.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6628 2.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5289 1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 3.5519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6428 2.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0648 -2.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3327 -2.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1988 -3.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5289 3.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3949 1.5481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3268 4.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 -1.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5278 1.3581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3591 -0.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5086 1.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6017 -1.6419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3338 -0.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9308 2.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3178 0.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4672 2.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4508 3.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0523 2.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1303 0.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9274 0.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5066 3.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3681 4.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1059 2.1286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8548 1.8560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 -3.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1988 -4.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8389 2.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0658 3.3581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2189 3.5850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7049 1.0111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9318 1.8581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0849 2.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8018 4.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9283 4.7929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8519 3.9194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 3.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6015 3.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 2.8061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 7 1 0 0 0 0 2 8 2 0 0 0 0 2 9 2 0 0 0 0 2 32 1 0 0 0 0 10 16 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 17 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 18 2 0 0 0 0 13 23 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 16 24 2 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 33 1 0 0 0 0 19 24 1 0 0 0 0 19 39 1 0 0 0 0 20 25 2 0 0 0 0 20 40 1 0 0 0 0 21 26 2 0 0 0 0 21 41 1 0 0 0 0 22 27 2 0 0 0 0 22 42 1 0 0 0 0 23 32 2 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 35 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 36 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 37 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 38 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 34 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 M CHG 4 3 1 4 -1 7 -1 11 1 M END > 50108 > 1 > 1040 > 7 > 0 > 7 > AAADceB7OCBgAAAAAAAAAAAAAAAAAAAAAAAwYIAAAAAAAAABQAAAHAQAAAAADAjBWAQywYMAAAKgAyRiRHDCAEAhAgAIiBgYZJgIICLAkZGEIAhggADIyAcQgMAOCAgAgAAEAAAQEAEAAAgAAAAAAAAAAA== > sodium;2-[[4-(diethylamino)phenyl]-(4-diethyliminiocyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate > sodium;2-[[4-(diethylamino)phenyl]-(4-diethyliminio-1-cyclohexa-2,5-dienylidene)methyl]benzene-1,4-disulfonate > sodium;2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate > sodium;2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate > sodium;2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate > sodium;2-[[4-(diethylamino)phenyl]-(4-diethyliminiocyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate > InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-19-24(36(30,31)32)17-18-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1 > NLUFDZBOHMOBOE-UHFFFAOYSA-M > 566.15212334 > C27H31N2NaO6S2 > 566.7 > CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+] > CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+] > 137 > 566.15212334 > 0 > 38 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 13 18 8 13 23 8 14 19 8 14 20 8 16 24 8 16 25 8 18 33 8 19 24 8 20 25 8 23 32 8 32 34 8 33 34 8 $$$$