methyl 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate CAS Name: 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate Traditional Name: 13-cyclohexyl-5-phenethyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester Formula: C32H34N2O2 MolecularWeight: 478.62456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCN(C4=CC=CC=C43)CCC5=CC=CC=C5)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCN(C4=CC=CC=C43)CCC5=CC=CC=C5)C6CCCCC6

InChI

InChI=1S/C32H34N2O2/c1-36-32(35)25-16-17-26-29(22-25)34-21-20-33(19-18-23-10-4-2-5-11-23)28-15-9-8-14-27(28)31(34)30(26)24-12-6-3-7-13-24/h2,4-5,8-11,14-17,22,24H,3,6-7,12-13,18-21H2,1H3