methyl 4-(2-chloranyl-4-methoxy-phenyl)-2-methyl-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(2-chloranyl-4-methoxy-phenyl)-2-methyl-3-oxidanylidene-butanoate Openeye Name: methyl 4-(2-chloro-4-methoxy-phenyl)-2-methyl-3-oxo-butanoate CAS Name: 4-(2-chloro-4-methoxyphenyl)-2-methyl-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-methoxyphenyl)-2-methyl-3-oxobutanoate Traditional Name: 4-(2-chloro-4-methoxy-phenyl)-3-keto-2-methyl-butyric acid methyl ester Formula: C13H15ClO4 MolecularWeight: 270.7088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClO4/c1-8(13(16)18-3)12(15)6-9-4-5-10(17-2)7-11(9)14/h4-5,7-8H,6H2,1-3H3