[(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [(1R)-2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [(1R)-2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C21H14ClF2NO3 MolecularWeight: 401.790566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)NC2=CC=C(C=C2)F)OC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H14ClF2NO3/c22-16-7-4-8-17(24)18(16)21(27)28-19(13-5-2-1-3-6-13)20(26)25-15-11-9-14(23)10-12-15/h1-12,19H,(H,25,26)/t19-/m1/s1