13-cyclohexyl-5-ethanoyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-5-ethanoyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Openeye Name: 5-acetyl-13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid CAS Name: 5-acetyl-13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid IUPAC Name: 5-acetyl-13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Traditional Name: 5-acetyl-13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C41)C5CCCCC5

Isomeric SMILES

CC(=O)N1CCN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C41)C5CCCCC5

InChI

InChI=1S/C25H26N2O3/c1-16(28)26-13-14-27-22-15-18(25(29)30)11-12-19(22)23(17-7-3-2-4-8-17)24(27)20-9-5-6-10-21(20)26/h5-6,9-12,15,17H,2-4,7-8,13-14H2,1H3,(H,29,30)