[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C14H18FNO4 MolecularWeight: 283.295423

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1)OC)F

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=CC(=C(C=C1)OC)F

InChI

InChI=1S/C14H18FNO4/c1-4-7-16-13(17)9(2)20-14(18)10-5-6-12(19-3)11(15)8-10/h5-6,8-9H,4,7H2,1-3H3,(H,16,17)/t9-/m0/s1