56642835 -OEChem-03282405502D 39 41 0 0 0 0 0 0 0999 V2000 6.8038 0.1262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -0.2102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9378 1.6262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1582 0.5330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4378 3.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4378 3.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8143 3.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0612 3.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0368 2.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8387 2.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9378 0.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0717 0.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9672 -0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -1.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -1.9898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.0943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -2.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -3.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -3.7123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 -3.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5757 4.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8791 4.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9964 4.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2998 4.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 3.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2556 2.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6198 2.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4478 3.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4168 2.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8988 1.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9767 1.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4587 2.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4279 -1.2832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0293 1.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 -2.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 -3.0726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1278 -4.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -4.3833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 5 1 0 0 0 0 2 15 1 0 0 0 0 3 17 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 13 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 M END > 56642835 > 1 > 576 > 4 > 1 > 1 > AAADceB7MAAAAAAAAAAAAAAAAAAAAQAAAAAgAAAABYAAAAAAAAAAHgAUAAAADAzBgAQAAANQAACIAqVSUACAAAAgIgAoCAGIAEgIRAIAgQAUEAAAhgCIgYMQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (6Z)-6-[3-(azepane-1-carbonyl)-2H-isoxazol-5-ylidene]cyclohexa-2,4-dien-1-one > (6Z)-6-[3-[1-azepanyl(oxo)methyl]-2H-isoxazol-5-ylidene]-1-cyclohexa-2,4-dienone > (6Z)-6-[3-(azepane-1-carbonyl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,4-dien-1-one > (6Z)-6-[3-(azepane-1-carbonyl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,4-dien-1-one > (6Z)-6-[3-(azepan-1-ylcarbonyl)-2H-1,2-oxazol-5-ylidene]cyclohexa-2,4-dien-1-one > (6Z)-6-[3-(azepane-1-carbonyl)-3-isoxazolin-5-ylidene]cyclohexa-2,4-dien-1-one > InChI=1S/C16H18N2O3/c19-14-8-4-3-7-12(14)15-11-13(17-21-15)16(20)18-9-5-1-2-6-10-18/h3-4,7-8,11,17H,1-2,5-6,9-10H2/b15-12- > MJNKPLOSILDTCK-QINSGFPZSA-N > 2.6 > 286.13174244 > C16H18N2O3 > 286.33 > C1CCCN(CC1)C(=O)C2=CC(=C3C=CC=CC3=O)ON2 > C1CCCN(CC1)C(=O)C2=C/C(=C/3\C=CC=CC3=O)/ON2 > 58.6 > 286.13174244 > 0 > 21 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 $$$$