[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-phenylpropanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-phenylpropanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H16N2O3/c15-9-4-10-16-13(17)11-19-14(18)8-7-12-5-2-1-3-6-12/h1-3,5-6H,4,7-8,10-11H2,(H,16,17)