3-butanoyl-4-oxidanyl-benzoic acid

Systemtic Name: 3-butanoyl-4-oxidanyl-benzoic acid Openeye Name: 3-butanoyl-4-hydroxy-benzoic acid CAS Name: 4-hydroxy-3-(1-oxobutyl)benzoic acid IUPAC Name: 3-butanoyl-4-hydroxybenzoic acid Traditional Name: 3-butyryl-4-hydroxy-benzoic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O4/c1-2-3-9(12)8-6-7(11(14)15)4-5-10(8)13/h4-6,13H,2-3H2,1H3,(H,14,15)