4-(5-chloranyl-2,4-dimethoxy-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-chloranyl-2,4-dimethoxy-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2,4-dimethoxy-phenyl)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2,4-dimethoxyphenyl)-4-oxobutanoic acid IUPAC Name: 4-(5-chloro-2,4-dimethoxyphenyl)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2,4-dimethoxy-phenyl)-4-keto-butyric acid Formula: C12H13ClO5 MolecularWeight: 272.68162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)CCC(=O)O)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)CCC(=O)O)Cl)OC

InChI

InChI=1S/C12H13ClO5/c1-17-10-6-11(18-2)8(13)5-7(10)9(14)3-4-12(15)16/h5-6H,3-4H2,1-2H3,(H,15,16)