methyl 4-chloranyl-2,2-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-chloranyl-2,2-dimethyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-chloro-2,2-dimethyl-4-oxo-butanoate CAS Name: 4-chloro-2,2-dimethyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-chloro-2,2-dimethyl-4-oxobutanoate Traditional Name: 4-chloro-4-keto-2,2-dimethyl-butyric acid methyl ester Formula: C7H11ClO3 MolecularWeight: 178.61344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11ClO3/c1-7(2,4-5(8)9)6(10)11-3/h4H2,1-3H3