[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 3-acetamidopropanoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 3-acetamidopropanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C14H14ClN3O4 MolecularWeight: 323.73166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)OCC(=O)NC1=CC(=C(C=C1)C#N)Cl

Isomeric SMILES

CC(=O)NCCC(=O)OCC(=O)NC1=CC(=C(C=C1)C#N)Cl

InChI

InChI=1S/C14H14ClN3O4/c1-9(19)17-5-4-14(21)22-8-13(20)18-11-3-2-10(7-16)12(15)6-11/h2-3,6H,4-5,8H2,1H3,(H,17,19)(H,18,20)