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

Systemtic Name: 2-[(4-chloranyl-2-fluoranyl-phenyl)-methanoyl-amino]-3-methyl-butanoic acid Openeye Name: 2-(4-chloro-2-fluoro-N-formyl-anilino)-3-methyl-butanoic acid CAS Name: 2-(4-chloro-2-fluoro-N-formylanilino)-3-methylbutanoic acid IUPAC Name: 2-(4-chloro-2-fluoro-N-formylanilino)-3-methylbutanoic acid Traditional Name: 2-(4-chloro-2-fluoro-N-formyl-anilino)-3-methyl-butyric acid Formula: C12H13ClFNO3 MolecularWeight: 273.687923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(C=O)C1=C(C=C(C=C1)Cl)F

Isomeric SMILES

CC(C)C(C(=O)O)N(C=O)C1=C(C=C(C=C1)Cl)F

InChI

InChI=1S/C12H13ClFNO3/c1-7(2)11(12(17)18)15(6-16)10-4-3-8(13)5-9(10)14/h3-7,11H,1-2H3,(H,17,18)