3-chloranyl-4-(4-methylphenyl)-2-oxidanylidene-butanoic acid

Systemtic Name: 3-chloranyl-4-(4-methylphenyl)-2-oxidanylidene-butanoic acid Openeye Name: 3-chloro-2-oxo-4-(p-tolyl)butanoic acid CAS Name: 3-chloro-4-(4-methylphenyl)-2-oxobutanoic acid IUPAC Name: 3-chloro-4-(4-methylphenyl)-2-oxobutanoic acid Traditional Name: 3-chloro-2-keto-4-(p-tolyl)butyric acid Formula: C11H11ClO3 MolecularWeight: 226.65624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)C(=O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)C(=O)O)Cl

InChI

InChI=1S/C11H11ClO3/c1-7-2-4-8(5-3-7)6-9(12)10(13)11(14)15/h2-5,9H,6H2,1H3,(H,14,15)