4-acetamido-5-(2,2-dimethylpropanoylamino)-2-fluoranyl-benzoic acid

Systemtic Name: 4-acetamido-5-(2,2-dimethylpropanoylamino)-2-fluoranyl-benzoic acid Openeye Name: 4-acetamido-5-(2,2-dimethylpropanoylamino)-2-fluoro-benzoic acid CAS Name: 4-acetamido-5-[(2,2-dimethyl-1-oxopropyl)amino]-2-fluorobenzoic acid IUPAC Name: 4-acetamido-5-(2,2-dimethylpropanoylamino)-2-fluorobenzoic acid Traditional Name: 4-acetamido-2-fluoro-5-(pivaloylamino)benzoic acid Formula: C14H17FN2O4 MolecularWeight: 296.294183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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