16746405 -OEChem-03292408162D 53 57 0 1 0 0 0 0 0999 V2000 6.9540 0.2787 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.7435 -0.8342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1189 0.2900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 0.9395 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3142 1.6838 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2220 1.2787 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6678 1.1457 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1471 0.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3572 2.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 2.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 2.8406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8632 -0.3779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 1.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 2.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -1.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8201 1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 3.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8201 2.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7065 -1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4013 -2.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 1.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 3.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5003 -2.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1951 -3.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6201 1.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6201 2.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2446 -3.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1488 0.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9456 2.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7421 0.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 0.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9746 2.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8103 1.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4176 3.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8324 3.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5385 0.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5859 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4615 -0.0126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4385 -0.6091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1909 0.1485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5511 3.0887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 3.8987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -1.2530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9906 -1.8316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7068 0.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7068 3.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -2.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6566 -3.4168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1558 1.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1558 3.1116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1167 -3.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 8 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 30 1 6 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 31 1 1 0 0 0 6 11 1 6 0 0 0 6 32 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 6 0 0 0 7 33 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 12 2 0 0 0 0 10 36 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 17 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 16 19 2 0 0 0 0 16 43 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 18 23 2 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 24 2 0 0 0 0 21 25 1 0 0 0 0 21 45 1 0 0 0 0 22 26 2 0 0 0 0 22 46 1 0 0 0 0 23 27 1 0 0 0 0 23 47 1 0 0 0 0 24 28 1 0 0 0 0 24 48 1 0 0 0 0 25 29 2 0 0 0 0 25 49 1 0 0 0 0 26 29 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END > 16746405 > 1 > 626 > 1 > 0 > 3 > AAADceB6IAAAEAAAAAAAAAAAAAAAAWAAAAAwYMEAAAAAAEDBVAAAHgBAAAABrSjBmAQyAMMAAACIAiFSEACCAAAgAAQIiAEIBKgIIDKAkRGEIAhghgCIihcciMCOwAACEAAQgACAAAQgACEAAAAAAAAAAA== > (3R,3aS,7R,7aS)-2-benzyl-3-(1-bromo-2-naphthyl)-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > (3R,3aS,7R,7aS)-3-(1-bromo-2-naphthalenyl)-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > (3R,3aS,7R,7aS)-2-benzyl-3-(1-bromonaphthalen-2-yl)-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > (3R,3aS,7R,7aS)-2-benzyl-3-(1-bromonaphthalen-2-yl)-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > (3R,3aS,7R,7aS)-3-(1-bromanylnaphthalen-2-yl)-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > (3R,3aS,7R,7aS)-2-benzyl-3-(1-bromo-2-naphthyl)-7-methyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one > InChI=1S/C26H24BrNO/c1-17-8-7-13-21-23(17)26(29)28(16-18-9-3-2-4-10-18)25(21)22-15-14-19-11-5-6-12-20(19)24(22)27/h2-7,9-15,17,21,23,25H,8,16H2,1H3/t17-,21+,23+,25-/m1/s1 > GQOBBRUOMREMLT-PFFAGKLISA-N > 6.2 > 445.10413 > C26H24BrNO > 446.4 > CC1CC=CC2C1C(=O)N(C2C3=C(C4=CC=CC=C4C=C3)Br)CC5=CC=CC=C5 > C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N([C@H]2C3=C(C4=CC=CC=C4C=C3)Br)CC5=CC=CC=C5 > 20.3 > 445.10413 > 0 > 29 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 15 8 11 16 8 15 18 8 16 19 8 17 21 8 17 22 8 18 20 8 18 23 8 19 20 8 20 24 8 21 25 8 22 26 8 23 27 8 24 28 8 25 29 8 26 29 8 27 28 8 4 30 6 5 31 5 6 11 6 7 13 6 $$$$