methyl 2-(4-bromanyl-2-methyl-phenyl)butanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)Br)C)C(=O)OC

Isomeric SMILES

CCC(C1=C(C=C(C=C1)Br)C)C(=O)OC

InChI

InChI=1S/C12H15BrO2/c1-4-10(12(14)15-3)11-6-5-9(13)7-8(11)2/h5-7,10H,4H2,1-3H3