5-ethanoyl-3-ethyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-ethanoyl-3-ethyl-2-oxidanyl-benzoic acid Openeye Name: 5-acetyl-3-ethyl-2-hydroxy-benzoic acid CAS Name: 5-acetyl-3-ethyl-2-hydroxybenzoic acid IUPAC Name: 5-acetyl-3-ethyl-2-hydroxybenzoic acid Traditional Name: 5-acetyl-3-ethyl-2-hydroxy-benzoic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1O)C(=O)O)C(=O)C

Isomeric SMILES

CCC1=CC(=CC(=C1O)C(=O)O)C(=O)C

InChI

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