[(2R)-1-[(4-chloranyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] (3R)-3-phenylbutanoate

Systemtic Name: [(2R)-1-[(4-chloranyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] (3R)-3-phenylbutanoate Openeye Name: [(1R)-2-(4-chloro-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [(2R)-1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [(1R)-2-(4-chloro-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C19H19ClFNO3 MolecularWeight: 363.810463

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(=O)NC1=C(C=C(C=C1)Cl)F)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CC(=O)O[C@H](C)C(=O)NC1=C(C=C(C=C1)Cl)F)C2=CC=CC=C2

InChI

InChI=1S/C19H19ClFNO3/c1-12(14-6-4-3-5-7-14)10-18(23)25-13(2)19(24)22-17-9-8-15(20)11-16(17)21/h3-9,11-13H,10H2,1-2H3,(H,22,24)/t12-,13-/m1/s1