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octan-2-yl 4-(bromomethyl)benzoate

octan-2-yl 4-(bromomethyl)benzoate

Systemtic Name:octan-2-yl 4-(bromomethyl)benzoate
Openeye Name:1-methylheptyl 4-(bromomethyl)benzoate
CAS Name:4-(bromomethyl)benzoic acid octan-2-yl ester
IUPAC Name:octan-2-yl 4-(bromomethyl)benzoate
Traditional Name:4-(bromomethyl)benzoic acid 1-methylheptyl ester
Formula: C16H23BrO2
MolecularWeight: 327.25662
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H23BrO2/c1-3-4-5-6-7-13(2)19-16(18)15-10-8-14(12-17)9-11-15/h8-11,13H,3-7,12H2,1-2H3


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