2-(2-carboxyethyl)-5-ethanoyl-benzoic acid

Systemtic Name: 2-(2-carboxyethyl)-5-ethanoyl-benzoic acid Openeye Name: 5-acetyl-2-(2-carboxyethyl)benzoic acid CAS Name: 5-acetyl-2-(2-carboxyethyl)benzoic acid IUPAC Name: 5-acetyl-2-(2-carboxyethyl)benzoic acid Traditional Name: 5-acetyl-2-(2-carboxyethyl)benzoic acid Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)CCC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)CCC(=O)O)C(=O)O

InChI

InChI=1S/C12H12O5/c1-7(13)9-3-2-8(4-5-11(14)15)10(6-9)12(16)17/h2-3,6H,4-5H2,1H3,(H,14,15)(H,16,17)