[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-benzamidoethanoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-benzamidoethanoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] 2-benzamidoacetate CAS Name: 2-benzamidoacetic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] 2-benzamidoacetate Traditional Name: 2-benzamidoacetic acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C19H17N3O4 MolecularWeight: 351.35598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C19H17N3O4/c20-11-10-14-6-8-16(9-7-14)22-17(23)13-26-18(24)12-21-19(25)15-4-2-1-3-5-15/h1-9H,10,12-13H2,(H,21,25)(H,22,23)