[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C13H20N2O3 MolecularWeight: 252.3095

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)NC1(CCCCC1)C#N

Isomeric SMILES

CCCC(=O)OCC(=O)NC1(CCCCC1)C#N

InChI

InChI=1S/C13H20N2O3/c1-2-6-12(17)18-9-11(16)15-13(10-14)7-4-3-5-8-13/h2-9H2,1H3,(H,15,16)