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

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)propanoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] 3-(4-fluorophenyl)propanoate CAS Name: 3-(4-fluorophenyl)propanoic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] 3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)propionic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C19H17FN2O3 MolecularWeight: 340.348283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC#N)C(=O)COC(=O)CCC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC=C(C=C1)N(CC#N)C(=O)COC(=O)CCC2=CC=C(C=C2)F

InChI

InChI=1S/C19H17FN2O3/c20-16-9-6-15(7-10-16)8-11-19(24)25-14-18(23)22(13-12-21)17-4-2-1-3-5-17/h1-7,9-10H,8,11,13-14H2