[1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-benzamidopropanoate

Systemtic Name: [1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-benzamidopropanoate Openeye Name: [2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-benzamidopropanoate CAS Name: 2-benzamidopropanoic acid [1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-cyanoanilino)-1-oxopropan-2-yl] 2-benzamidopropanoate Traditional Name: 2-benzamidopropionic acid [2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)NC1=CC=CC(=C1)C#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)OC(C)C(=O)NC1=CC=CC(=C1)C#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H19N3O4/c1-13(22-19(25)16-8-4-3-5-9-16)20(26)27-14(2)18(24)23-17-10-6-7-15(11-17)12-21/h3-11,13-14H,1-2H3,(H,22,25)(H,23,24)