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

Systemtic Name: [(2S)-1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-phenoxypropanoate Openeye Name: [(1S)-2-(3-chloro-4-fluoro-anilino)-1-methyl-2-oxo-ethyl] 3-phenoxypropanoate CAS Name: 3-phenoxypropanoic acid [(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl] 3-phenoxypropanoate Traditional Name: 3-phenoxypropionic acid [(1S)-2-(3-chloro-4-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C18H17ClFNO4 MolecularWeight: 365.783283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)Cl)OC(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)F)Cl)OC(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C18H17ClFNO4/c1-12(18(23)21-13-7-8-16(20)15(19)11-13)25-17(22)9-10-24-14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,21,23)/t12-/m0/s1