(2S)-4-[(5-fluoranyl-2-methyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-phenyl-butanoate

Systemtic Name: (2S)-4-[(5-fluoranyl-2-methyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-phenyl-butanoate Openeye Name: (2S)-4-(5-fluoro-2-methyl-anilino)-2-methyl-4-oxo-2-phenyl-butanoate CAS Name: (2S)-4-(5-fluoro-2-methylanilino)-2-methyl-4-oxo-2-phenylbutanoate IUPAC Name: (2S)-4-(5-fluoro-2-methylanilino)-2-methyl-4-oxo-2-phenylbutanoate Traditional Name: (2S)-4-(5-fluoro-2-methyl-anilino)-4-keto-2-methyl-2-phenyl-butyrate Formula: C18H17FNO3- MolecularWeight: 314.330883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18FNO3/c1-12-8-9-14(19)10-15(12)20-16(21)11-18(2,17(22)23)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,20,21)(H,22,23)/p-1/t18-/m0/s1