4-(3-ethanoyl-4-oxidanyl-phenyl)-2-oxidanylidene-butanoic acid

Systemtic Name: 4-(3-ethanoyl-4-oxidanyl-phenyl)-2-oxidanylidene-butanoic acid Openeye Name: 4-(3-acetyl-4-hydroxy-phenyl)-2-oxo-butanoic acid CAS Name: 4-(3-acetyl-4-hydroxyphenyl)-2-oxobutanoic acid IUPAC Name: 4-(3-acetyl-4-hydroxyphenyl)-2-oxobutanoic acid Traditional Name: 4-(3-acetyl-4-hydroxy-phenyl)-2-keto-butyric acid Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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