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

Systemtic Name: [(2R)-1-[(4-chloranyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybutanoate Openeye Name: [(1R)-2-(4-chloro-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [(2R)-1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-chloro-2-fluoroanilino)-1-oxopropan-2-yl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [(1R)-2-(4-chloro-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C19H19ClFNO4 MolecularWeight: 379.809863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)F)OC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)Cl)F)OC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C19H19ClFNO4/c1-13(19(24)22-17-10-9-14(20)12-16(17)21)26-18(23)8-5-11-25-15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13H,5,8,11H2,1H3,(H,22,24)/t13-/m1/s1