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

Systemtic Name: 4-acetamido-5-(butanoylamino)-2-fluoranyl-benzoic acid Openeye Name: 4-acetamido-5-(butanoylamino)-2-fluoro-benzoic acid CAS Name: 4-acetamido-2-fluoro-5-(1-oxobutylamino)benzoic acid IUPAC Name: 4-acetamido-5-(butanoylamino)-2-fluorobenzoic acid Traditional Name: 4-acetamido-5-butyramido-2-fluoro-benzoic acid Formula: C13H15FN2O4 MolecularWeight: 282.267603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15FN2O4/c1-3-4-12(18)16-10-5-8(13(19)20)9(14)6-11(10)15-7(2)17/h5-6H,3-4H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)