methyl 13-cyclohexyl-6-(4-morpholin-4-ylcarbonylpiperazin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

Systemtic Name: methyl 13-cyclohexyl-6-(4-morpholin-4-ylcarbonylpiperazin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Openeye Name: methyl 13-cyclohexyl-6-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate CAS Name: 13-cyclohexyl-6-[[4-[4-morpholinyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid methyl ester IUPAC Name: methyl 13-cyclohexyl-6-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylate Traditional Name: 13-cyclohexyl-6-[4-(morpholine-4-carbonyl)piperazine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid methyl ester Formula: C35H40N4O5 MolecularWeight: 596.7159

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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)N5CCN(CC5)C(=O)N6CCOCC6)C7CCCCC7

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(=CC4=CC=CC=C43)C(=O)N5CCN(CC5)C(=O)N6CCOCC6)C7CCCCC7

InChI

InChI=1S/C35H40N4O5/c1-43-34(41)26-11-12-29-30(22-26)39-23-27(33(40)36-13-15-37(16-14-36)35(42)38-17-19-44-20-18-38)21-25-9-5-6-10-28(25)32(39)31(29)24-7-3-2-4-8-24/h5-6,9-12,21-22,24H,2-4,7-8,13-20,23H2,1H3