(4-chloranyl-3,5-dimethyl-phenyl) butanoate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) butanoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) butanoate CAS Name: butanoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) butanoate Traditional Name: butyric acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C12H15ClO2 MolecularWeight: 226.6993

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC(=C(C(=C1)C)Cl)C

Isomeric SMILES

CCCC(=O)OC1=CC(=C(C(=C1)C)Cl)C

InChI

InChI=1S/C12H15ClO2/c1-4-5-11(14)15-10-6-8(2)12(13)9(3)7-10/h6-7H,4-5H2,1-3H3