4-acetamido-2-fluoranyl-5-(2-methylbutanoylamino)benzoic acid

Systemtic Name: 4-acetamido-2-fluoranyl-5-(2-methylbutanoylamino)benzoic acid Openeye Name: 4-acetamido-2-fluoro-5-(2-methylbutanoylamino)benzoic acid CAS Name: 4-acetamido-2-fluoro-5-[(2-methyl-1-oxobutyl)amino]benzoic acid IUPAC Name: 4-acetamido-2-fluoro-5-(2-methylbutanoylamino)benzoic acid Traditional Name: 4-acetamido-2-fluoro-5-(2-methylbutanoylamino)benzoic acid Formula: C14H17FN2O4 MolecularWeight: 296.294183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=C(C=C(C(=C1)C(=O)O)F)NC(=O)C

Isomeric SMILES

CCC(C)C(=O)NC1=C(C=C(C(=C1)C(=O)O)F)NC(=O)C

InChI

InChI=1S/C14H17FN2O4/c1-4-7(2)13(19)17-11-5-9(14(20)21)10(15)6-12(11)16-8(3)18/h5-7H,4H2,1-3H3,(H,16,18)(H,17,19)(H,20,21)