4-(2-chloranyl-4-methoxy-3-methyl-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-chloranyl-4-methoxy-3-methyl-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-chloro-4-methoxy-3-methyl-phenyl)-4-oxo-butanoic acid CAS Name: 4-(2-chloro-4-methoxy-3-methylphenyl)-4-oxobutanoic acid IUPAC Name: 4-(2-chloro-4-methoxy-3-methylphenyl)-4-oxobutanoic acid Traditional Name: 4-(2-chloro-4-methoxy-3-methyl-phenyl)-4-keto-butyric acid Formula: C12H13ClO4 MolecularWeight: 256.68222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)C(=O)CCC(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1Cl)C(=O)CCC(=O)O)OC

InChI

InChI=1S/C12H13ClO4/c1-7-10(17-2)5-3-8(12(7)13)9(14)4-6-11(15)16/h3,5H,4,6H2,1-2H3,(H,15,16)