[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-cyanobenzoate

Systemtic Name: [(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-cyanobenzoate Openeye Name: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [(1R)-2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H15FN2O3 MolecularWeight: 374.364503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H15FN2O3/c23-18-9-11-19(12-10-18)25-21(26)20(16-6-2-1-3-7-16)28-22(27)17-8-4-5-15(13-17)14-24/h1-13,20H,(H,25,26)/t20-/m1/s1