[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 1H-indole-2-carboxylate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 1H-indole-2-carboxylate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C19H21N3O3/c1-13(17(23)22-19(12-20)9-5-2-6-10-19)25-18(24)16-11-14-7-3-4-8-15(14)21-16/h3-4,7-8,11,13,21H,2,5-6,9-10H2,1H3,(H,22,23)