(4-bromanyl-2,6-dimethyl-phenyl) butanoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) butanoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) butanoate CAS Name: butanoic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) butanoate Traditional Name: butyric acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C12H15BrO2 MolecularWeight: 271.1503

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1C)Br)C

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1C)Br)C

InChI

InChI=1S/C12H15BrO2/c1-4-5-11(14)15-12-8(2)6-10(13)7-9(12)3/h6-7H,4-5H2,1-3H3