(2S)-4-[(3-fluoranyl-4-methyl-phenyl)amino]-4-oxidanylidene-2-phenyl-butanoate

Systemtic Name: (2S)-4-[(3-fluoranyl-4-methyl-phenyl)amino]-4-oxidanylidene-2-phenyl-butanoate Openeye Name: (2S)-4-(3-fluoro-4-methyl-anilino)-4-oxo-2-phenyl-butanoate CAS Name: (2S)-4-(3-fluoro-4-methylanilino)-4-oxo-2-phenylbutanoate IUPAC Name: (2S)-4-(3-fluoro-4-methylanilino)-4-oxo-2-phenylbutanoate Traditional Name: (2S)-4-(3-fluoro-4-methyl-anilino)-4-keto-2-phenyl-butyrate Formula: C17H15FNO3- MolecularWeight: 300.304303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(C2=CC=CC=C2)C(=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[C@@H](C2=CC=CC=C2)C(=O)[O-])F

InChI

InChI=1S/C17H16FNO3/c1-11-7-8-13(9-15(11)18)19-16(20)10-14(17(21)22)12-5-3-2-4-6-12/h2-9,14H,10H2,1H3,(H,19,20)(H,21,22)/p-1/t14-/m0/s1