5-(butanoylamino)-3-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-(butanoylamino)-3-methyl-2-oxidanyl-benzoic acid Openeye Name: 5-(butanoylamino)-2-hydroxy-3-methyl-benzoic acid CAS Name: 2-hydroxy-3-methyl-5-(1-oxobutylamino)benzoic acid IUPAC Name: 5-(butanoylamino)-2-hydroxy-3-methylbenzoic acid Traditional Name: 5-butyramido-2-hydroxy-3-methyl-benzoic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4/c1-3-4-10(14)13-8-5-7(2)11(15)9(6-8)12(16)17/h5-6,15H,3-4H2,1-2H3,(H,13,14)(H,16,17)