methyl 4-chloranyl-3,3-dimethyl-butanoate

Systemtic Name: methyl 4-chloranyl-3,3-dimethyl-butanoate Openeye Name: methyl 4-chloro-3,3-dimethyl-butanoate CAS Name: 4-chloro-3,3-dimethylbutanoic acid methyl ester IUPAC Name: methyl 4-chloro-3,3-dimethylbutanoate Traditional Name: 4-chloro-3,3-dimethyl-butyric acid methyl ester Formula: C7H13ClO2 MolecularWeight: 164.62992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)OC)CCl

Isomeric SMILES

CC(C)(CC(=O)OC)CCl

InChI

InChI=1S/C7H13ClO2/c1-7(2,5-8)4-6(9)10-3/h4-5H2,1-3H3