methyl (3aS,6R,6aS,10aR,11aS,11bR)-6-(3,5-dimethyl-4-oxidanyl-phenyl)-1,3,7,10-tetrakis(oxidanylidene)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindole-2-carboxylate

Systemtic Name: methyl (3aS,6R,6aS,10aR,11aS,11bR)-6-(3,5-dimethyl-4-oxidanyl-phenyl)-1,3,7,10-tetrakis(oxidanylidene)-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindole-2-carboxylate Openeye Name: methyl (3aS,6R,6aS,10aR,11aS,11bR)-6-(4-hydroxy-3,5-dimethyl-phenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindole-2-carboxylate CAS Name: (3aS,6R,6aS,10aR,11aS,11bR)-6-(4-hydroxy-3,5-dimethylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindole-2-carboxylic acid methyl ester IUPAC Name: methyl (3aS,6R,6aS,10aR,11aS,11bR)-6-(4-hydroxy-3,5-dimethylphenyl)-1,3,7,10-tetraoxo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphtho[2,3-e]isoindole-2-carboxylate Traditional Name: (3aS,6R,6aS,10aR,11aS,11bR)-6-(4-hydroxy-3,5-dimethyl-phenyl)-1,3,7,10-tetraketo-6a,9-diphenyl-4,6,10a,11,11a,11b-hexahydro-3aH-naphth[2,3-e]isoindole-2-carboxylic acid methyl ester Formula: C38H33NO7 MolecularWeight: 615.67112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C2C3=CCC4C(C3CC5C2(C(=O)C=C(C5=O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N(C4=O)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1O)C)[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)C(=O)OC

InChI

InChI=1S/C38H33NO7/c1-20-16-23(17-21(2)33(20)41)32-25-14-15-26-31(36(44)39(35(26)43)37(45)46-3)28(25)18-29-34(42)27(22-10-6-4-7-11-22)19-30(40)38(29,32)24-12-8-5-9-13-24/h4-14,16-17,19,26,28-29,31-32,41H,15,18H2,1-3H3/t26-,28+,29-,31-,32-,38-/m0/s1