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

Systemtic Name: 13-cyclohexyl-5-propan-2-yl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-5-isopropyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-5-propan-2-yl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-5-propan-2-yl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-5-isopropyl-6,7-dihydroindolo[1,2-d][1,4]benzodiazepine-10-carboxylic acid Formula: C26H30N2O2 MolecularWeight: 402.5286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N2O2/c1-17(2)27-14-15-28-23-16-19(26(29)30)12-13-20(23)24(18-8-4-3-5-9-18)25(28)21-10-6-7-11-22(21)27/h6-7,10-13,16-18H,3-5,8-9,14-15H2,1-2H3,(H,29,30)