methyl 3-bromanyl-4-pentyl-benzoate

Systemtic Name: methyl 3-bromanyl-4-pentyl-benzoate Openeye Name: methyl 3-bromo-4-pentyl-benzoate CAS Name: 3-bromo-4-pentylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-pentylbenzoate Traditional Name: 4-amyl-3-bromo-benzoic acid methyl ester Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)C(=O)OC)Br

InChI

InChI=1S/C13H17BrO2/c1-3-4-5-6-10-7-8-11(9-12(10)14)13(15)16-2/h7-9H,3-6H2,1-2H3