methyl 3-bromanyl-4-butyl-benzoate

Systemtic Name: methyl 3-bromanyl-4-butyl-benzoate Openeye Name: methyl 3-bromo-4-butyl-benzoate CAS Name: 3-bromo-4-butylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-butylbenzoate Traditional Name: 3-bromo-4-butyl-benzoic acid methyl ester Formula: C12H15BrO2 MolecularWeight: 271.1503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)OC)Br

InChI

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