[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(4-cyanophenyl)propanoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(4-cyanophenyl)propanoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] 3-(4-cyanophenyl)propanoate CAS Name: 3-(4-cyanophenyl)propanoic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] 3-(4-cyanophenyl)propanoate Traditional Name: 3-(4-cyanophenyl)propionic acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)C#N

InChI

InChI=1S/C20H17N3O3/c21-12-11-16-5-8-18(9-6-16)23-19(24)14-26-20(25)10-7-15-1-3-17(13-22)4-2-15/h1-6,8-9H,7,10-11,14H2,(H,23,24)