4-[(5-chloranyl-2-fluoranyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[(5-chloranyl-2-fluoranyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(5-chloro-2-fluoro-anilino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-fluoroanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(5-chloro-2-fluoroanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(5-chloro-2-fluoro-anilino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C14H17ClFNO3 MolecularWeight: 301.741083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)NC1=C(C=CC(=C1)Cl)F)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)NC1=C(C=CC(=C1)Cl)F)C(=O)O

InChI

InChI=1S/C14H17ClFNO3/c1-8(2)14(3,13(19)20)7-12(18)17-11-6-9(15)4-5-10(11)16/h4-6,8H,7H2,1-3H3,(H,17,18)(H,19,20)