ethyl 2-methyl-1-phenyl-5-[4-(phenylmethyl)phenyl]carbonyloxy-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-phenyl-5-[4-(phenylmethyl)phenyl]carbonyloxy-benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-(4-benzylbenzoyl)oxy-2-methyl-1-phenyl-benzo[g]indole-3-carboxylate CAS Name: 2-methyl-5-[oxo-[4-(phenylmethyl)phenyl]methoxy]-1-phenyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-benzylbenzoyl)oxy-2-methyl-1-phenylbenzo[g]indole-3-carboxylate Traditional Name: 5-(4-benzylbenzoyl)oxy-2-methyl-1-phenyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C36H29NO4 MolecularWeight: 539.61976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)CC5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)CC5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C36H29NO4/c1-3-40-36(39)33-24(2)37(28-14-8-5-9-15-28)34-30-17-11-10-16-29(30)32(23-31(33)34)41-35(38)27-20-18-26(19-21-27)22-25-12-6-4-7-13-25/h4-21,23H,3,22H2,1-2H3