pentan-2-yl 4-(bromomethyl)benzoate

Systemtic Name: pentan-2-yl 4-(bromomethyl)benzoate Openeye Name: 1-methylbutyl 4-(bromomethyl)benzoate CAS Name: 4-(bromomethyl)benzoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl 4-(bromomethyl)benzoate Traditional Name: 4-(bromomethyl)benzoic acid 1-methylbutyl ester Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C1=CC=C(C=C1)CBr

Isomeric SMILES

CCCC(C)OC(=O)C1=CC=C(C=C1)CBr

InChI

InChI=1S/C13H17BrO2/c1-3-4-10(2)16-13(15)12-7-5-11(9-14)6-8-12/h5-8,10H,3-4,9H2,1-2H3