4-butoxy-3-ethanoyl-benzoic acid

Systemtic Name: 4-butoxy-3-ethanoyl-benzoic acid Openeye Name: 3-acetyl-4-butoxy-benzoic acid CAS Name: 3-acetyl-4-butoxybenzoic acid IUPAC Name: 3-acetyl-4-butoxybenzoic acid Traditional Name: 3-acetyl-4-butoxy-benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)O)C(=O)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)O)C(=O)C

InChI

InChI=1S/C13H16O4/c1-3-4-7-17-12-6-5-10(13(15)16)8-11(12)9(2)14/h5-6,8H,3-4,7H2,1-2H3,(H,15,16)