2-fluoranyl-6-(3-methylbutanoylamino)benzoic acid

Systemtic Name: 2-fluoranyl-6-(3-methylbutanoylamino)benzoic acid Openeye Name: 2-fluoro-6-(3-methylbutanoylamino)benzoic acid CAS Name: 2-fluoro-6-[(3-methyl-1-oxobutyl)amino]benzoic acid IUPAC Name: 2-fluoro-6-(3-methylbutanoylamino)benzoic acid Traditional Name: 2-fluoro-6-(isovalerylamino)benzoic acid Formula: C12H14FNO3 MolecularWeight: 239.242863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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