3-ethanoylbenzoate

Systemtic Name: 3-ethanoylbenzoate Openeye Name: 3-acetylbenzoate CAS Name: 3-acetylbenzoate IUPAC Name: 3-acetylbenzoate Traditional Name: 3-acetylbenzoate Formula: C9H7O3- MolecularWeight: 163.15008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C(=O)[O-]

InChI

InChI=1S/C9H8O3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3,(H,11,12)/p-1