2-acetamido-3-(4-fluoranyl-3-methyl-phenyl)propanoic acid

Systemtic Name: 2-acetamido-3-(4-fluoranyl-3-methyl-phenyl)propanoic acid Openeye Name: 2-acetamido-3-(4-fluoro-3-methyl-phenyl)propanoic acid CAS Name: 2-acetamido-3-(4-fluoro-3-methylphenyl)propanoic acid IUPAC Name: 2-acetamido-3-(4-fluoro-3-methylphenyl)propanoic acid Traditional Name: 2-acetamido-3-(4-fluoro-3-methyl-phenyl)propionic acid Formula: C12H14FNO3 MolecularWeight: 239.242863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC(C(=O)O)NC(=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CC(C(=O)O)NC(=O)C)F

InChI

InChI=1S/C12H14FNO3/c1-7-5-9(3-4-10(7)13)6-11(12(16)17)14-8(2)15/h3-5,11H,6H2,1-2H3,(H,14,15)(H,16,17)