methyl 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-oxidanylidene-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-oxidanylidene-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-oxo-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylate CAS Name: 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-oxo-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-oxo-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylate Traditional Name: 13-cyclohexyl-5-(2-dimethylaminoethyl)-6-keto-7H-indolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid methyl ester Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)CN2C3=C(C=CC(=C3)C(=O)OC)C(=C2C4=CC=CC=C41)C5CCCCC5

Isomeric SMILES

CN(C)CCN1C(=O)CN2C3=C(C=CC(=C3)C(=O)OC)C(=C2C4=CC=CC=C41)C5CCCCC5

InChI

InChI=1S/C28H33N3O3/c1-29(2)15-16-30-23-12-8-7-11-22(23)27-26(19-9-5-4-6-10-19)21-14-13-20(28(33)34-3)17-24(21)31(27)18-25(30)32/h7-8,11-14,17,19H,4-6,9-10,15-16,18H2,1-3H3