O10-methyl O6-(phenylmethyl) 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate

Systemtic Name: O10-methyl O6-(phenylmethyl) 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate Openeye Name: O6-benzyl O10-methyl 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate CAS Name: 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid O10-methyl ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 10-O-methyl 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylate Traditional Name: 13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-6,10-dicarboxylic acid O6-benzyl ester O10-methyl ester Formula: C33H31NO4 MolecularWeight: 505.60354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5)C6CCCCC6

InChI

InChI=1S/C33H31NO4/c1-37-32(35)25-16-17-28-29(19-25)34-20-26(33(36)38-21-22-10-4-2-5-11-22)18-24-14-8-9-15-27(24)31(34)30(28)23-12-6-3-7-13-23/h2,4-5,8-11,14-19,23H,3,6-7,12-13,20-21H2,1H3