(3aS,6S,6aS,10aR,11aS,11bR)-6-(4-hydroxyphenyl)-6a,9-diphenyl-2-[1-(phenylmethyl)piperidin-4-yl]-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone

Systemtic Name: (3aS,6S,6aS,10aR,11aS,11bR)-6-(4-hydroxyphenyl)-6a,9-diphenyl-2-[1-(phenylmethyl)piperidin-4-yl]-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone Openeye Name: (3aS,6S,6aS,10aR,11aS,11bR)-2-(1-benzyl-4-piperidyl)-6-(4-hydroxyphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone CAS Name: (3aS,6S,6aS,10aR,11aS,11bR)-6-(4-hydroxyphenyl)-6a,9-diphenyl-2-[1-(phenylmethyl)-4-piperidinyl]-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone IUPAC Name: (3aS,6S,6aS,10aR,11aS,11bR)-2-(1-benzylpiperidin-4-yl)-6-(4-hydroxyphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone Traditional Name: (3aS,6S,6aS,10aR,11aS,11bR)-2-(1-benzyl-4-piperidyl)-6-(4-hydroxyphenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphth[6,7-e]isoindole-1,3,7,10-diquinone Formula: C46H42N2O5 MolecularWeight: 702.83608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)C3CC=C4C(C3C2=O)CC5C(=O)C(=CC(=O)C5(C4C6=CC=C(C=C6)O)C7=CC=CC=C7)C8=CC=CC=C8)CC9=CC=CC=C9

Isomeric SMILES

C1CN(CCC1N2C(=O)[C@H]3CC=C4[C@H]([C@H]3C2=O)C[C@H]5C(=O)C(=CC(=O)[C@]5([C@H]4C6=CC=C(C=C6)O)C7=CC=CC=C7)C8=CC=CC=C8)CC9=CC=CC=C9

InChI

InChI=1S/C46H42N2O5/c49-34-18-16-31(17-19-34)42-35-20-21-36-41(45(53)48(44(36)52)33-22-24-47(25-23-33)28-29-10-4-1-5-11-29)38(35)26-39-43(51)37(30-12-6-2-7-13-30)27-40(50)46(39,42)32-14-8-3-9-15-32/h1-20,27,33,36,38-39,41-42,49H,21-26,28H2/t36-,38+,39-,41-,42-,46-/m0/s1