2-[2,4-bis(oxidanylidene)pentan-3-yl]benzoic acid

Systemtic Name: 2-[2,4-bis(oxidanylidene)pentan-3-yl]benzoic acid Openeye Name: 2-(1-acetyl-2-oxo-propyl)benzoic acid CAS Name: 2-(2,4-dioxopentan-3-yl)benzoic acid IUPAC Name: 2-(2,4-dioxopentan-3-yl)benzoic acid Traditional Name: 2-(1-acetyl-2-keto-propyl)benzoic acid Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CC=CC=C1C(=O)O)C(=O)C

Isomeric SMILES

CC(=O)C(C1=CC=CC=C1C(=O)O)C(=O)C

InChI

InChI=1S/C12H12O4/c1-7(13)11(8(2)14)9-5-3-4-6-10(9)12(15)16/h3-6,11H,1-2H3,(H,15,16)