2-[(2-fluoranyl-4-methyl-phenyl)amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(2-fluoranyl-4-methyl-phenyl)amino]-3-methyl-butanoic acid Openeye Name: 2-(2-fluoro-4-methyl-anilino)-3-methyl-butanoic acid CAS Name: 2-(2-fluoro-4-methylanilino)-3-methylbutanoic acid IUPAC Name: 2-(2-fluoro-4-methylanilino)-3-methylbutanoic acid Traditional Name: 2-(2-fluoro-4-methyl-anilino)-3-methyl-butyric acid Formula: C12H16FNO2 MolecularWeight: 225.259343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16FNO2/c1-7(2)11(12(15)16)14-10-5-4-8(3)6-9(10)13/h4-7,11,14H,1-3H3,(H,15,16)