13-cyclohexyl-6-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-6-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-6-[4-(4-pyridyl)piperazine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-6-[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-6-(4-pyridin-4-ylpiperazine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-6-[4-(4-pyridyl)piperazine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid Formula: C34H34N4O3 MolecularWeight: 546.65876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C3C4=CC=CC=C4C=C(CN3C5=C2C=CC(=C5)C(=O)O)C(=O)N6CCN(CC6)C7=CC=NC=C7

Isomeric SMILES

C1CCC(CC1)C2=C3C4=CC=CC=C4C=C(CN3C5=C2C=CC(=C5)C(=O)O)C(=O)N6CCN(CC6)C7=CC=NC=C7

InChI

InChI=1S/C34H34N4O3/c39-33(37-18-16-36(17-19-37)27-12-14-35-15-13-27)26-20-24-8-4-5-9-28(24)32-31(23-6-2-1-3-7-23)29-11-10-25(34(40)41)21-30(29)38(32)22-26/h4-5,8-15,20-21,23H,1-3,6-7,16-19,22H2,(H,40,41)