(2S,3S)-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-[(3-fluoro-4-methyl-benzoyl)amino]-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[[(3-fluoro-4-methylphenyl)-oxomethyl]amino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-[(3-fluoro-4-methylbenzoyl)amino]-3-hydroxybutanoate Traditional Name: (2S,3S)-2-[(3-fluoro-4-methyl-benzoyl)amino]-3-hydroxy-butyrate Formula: C12H13FNO4- MolecularWeight: 254.234323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(C(C)O)C(=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@@H]([C@H](C)O)C(=O)[O-])F

InChI

InChI=1S/C12H14FNO4/c1-6-3-4-8(5-9(6)13)11(16)14-10(7(2)15)12(17)18/h3-5,7,10,15H,1-2H3,(H,14,16)(H,17,18)/p-1/t7-,10-/m0/s1