4-(5-chloranyl-4-methyl-2-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-chloranyl-4-methyl-2-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2-hydroxy-4-methyl-phenyl)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-hydroxy-4-methylphenyl)-4-oxobutanoic acid IUPAC Name: 4-(5-chloro-2-hydroxy-4-methylphenyl)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2-hydroxy-4-methyl-phenyl)-4-keto-butyric acid Formula: C11H11ClO4 MolecularWeight: 242.65564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11ClO4/c1-6-4-10(14)7(5-8(6)12)9(13)2-3-11(15)16/h4-5,14H,2-3H2,1H3,(H,15,16)