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

Systemtic Name: 4-(2-methylpentanoylamino)-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-(2-methylpentanoylamino)benzoic acid CAS Name: 2-hydroxy-4-[(2-methyl-1-oxopentyl)amino]benzoic acid IUPAC Name: 2-hydroxy-4-(2-methylpentanoylamino)benzoic acid Traditional Name: 2-hydroxy-4-(2-methylpentanoylamino)benzoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-3-4-8(2)12(16)14-9-5-6-10(13(17)18)11(15)7-9/h5-8,15H,3-4H2,1-2H3,(H,14,16)(H,17,18)