4-(hexanoylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 4-(hexanoylamino)-2-oxidanyl-benzoic acid Openeye Name: 4-(hexanoylamino)-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-4-(1-oxohexylamino)benzoic acid IUPAC Name: 4-(hexanoylamino)-2-hydroxybenzoic acid Traditional Name: 4-(caproylamino)-2-hydroxy-benzoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-2-3-4-5-12(16)14-9-6-7-10(13(17)18)11(15)8-9/h6-8,15H,2-5H2,1H3,(H,14,16)(H,17,18)