[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C19H17N3O4 MolecularWeight: 351.35598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC=C1C#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC1=CC=CC=C1C#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H17N3O4/c1-13(21-18(24)14-7-3-2-4-8-14)19(25)26-12-17(23)22-16-10-6-5-9-15(16)11-20/h2-10,13H,12H2,1H3,(H,21,24)(H,22,23)/t13-/m0/s1