[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [(1S)-2-keto-1-methyl-2-(2-phenylanilino)ethyl] ester Formula: C22H17ClFNO3 MolecularWeight: 397.826683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C22H17ClFNO3/c1-14(28-22(27)18-12-11-16(23)13-19(18)24)21(26)25-20-10-6-5-9-17(20)15-7-3-2-4-8-15/h2-14H,1H3,(H,25,26)/t14-/m0/s1