(3aS,6R,6aS,10aR,11aS,11bR)-6-(3-ethoxy-4-oxidanyl-phenyl)-6a,9-diphenyl-2-(phenylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone

Systemtic Name: (3aS,6R,6aS,10aR,11aS,11bR)-6-(3-ethoxy-4-oxidanyl-phenyl)-6a,9-diphenyl-2-(phenylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone Openeye Name: (3aS,6R,6aS,10aR,11aS,11bR)-2-benzyl-6-(3-ethoxy-4-hydroxy-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone CAS Name: (3aS,6R,6aS,10aR,11aS,11bR)-6-(3-ethoxy-4-hydroxyphenyl)-6a,9-diphenyl-2-(phenylmethyl)-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[6,7-e]isoindole-1,3,7,10-tetrone IUPAC Name: (3aS,6R,6aS,10aR,11aS,11bR)-2-benzyl-6-(3-ethoxy-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,6R,6aS,10aR,11aS,11bR)-2-benzyl-6-(3-ethoxy-4-hydroxy-phenyl)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphth[6,7-e]isoindole-1,3,7,10-diquinone Formula: C43H37NO6 MolecularWeight: 663.75698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)CC8=CC=CC=C8)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H]2C3=CC[C@H]4[C@@H]([C@@H]3C[C@@H]5[C@]2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)CC8=CC=CC=C8)O

InChI

InChI=1S/C43H37NO6/c1-2-50-36-22-28(18-21-35(36)45)39-30-19-20-31-38(42(49)44(41(31)48)25-26-12-6-3-7-13-26)33(30)23-34-40(47)32(27-14-8-4-9-15-27)24-37(46)43(34,39)29-16-10-5-11-17-29/h3-19,21-22,24,31,33-34,38-39,45H,2,20,23,25H2,1H3/t31-,33+,34-,38-,39-,43-/m0/s1