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

Systemtic Name: methyl 4-chloranyl-2,2-dimethyl-butanoate Openeye Name: methyl 4-chloro-2,2-dimethyl-butanoate CAS Name: 4-chloro-2,2-dimethylbutanoic acid methyl ester IUPAC Name: methyl 4-chloro-2,2-dimethylbutanoate Traditional Name: 4-chloro-2,2-dimethyl-butyric acid methyl ester Formula: C7H13ClO2 MolecularWeight: 164.62992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCl)C(=O)OC

Isomeric SMILES

CC(C)(CCCl)C(=O)OC

InChI

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