[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-phenylbenzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 4-phenylbenzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C18H16N2O3 MolecularWeight: 308.33124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C18H16N2O3/c19-11-4-12-20-17(21)13-23-18(22)16-9-7-15(8-10-16)14-5-2-1-3-6-14/h1-3,5-10H,4,12-13H2,(H,20,21)