methyl 13-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-5-[2-(1-piperidyl)ethyl]-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate CAS Name: 13-cyclohexyl-5-[2-(1-piperidinyl)ethyl]-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-5-(2-piperidin-1-ylethyl)-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylate Traditional Name: 13-cyclohexyl-5-(2-piperidinoethyl)-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester Formula: C31H39N3O2 MolecularWeight: 485.66026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCN(C4=CC=CC=C43)CCN5CCCCC5)C6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CCN(C4=CC=CC=C43)CCN5CCCCC5)C6CCCCC6

InChI

InChI=1S/C31H39N3O2/c1-36-31(35)24-14-15-25-28(22-24)34-21-20-33(19-18-32-16-8-3-9-17-32)27-13-7-6-12-26(27)30(34)29(25)23-10-4-2-5-11-23/h6-7,12-15,22-23H,2-5,8-11,16-21H2,1H3