1-[2-(bromomethyl)phenyl]heptyl ethanoate

Systemtic Name: 1-[2-(bromomethyl)phenyl]heptyl ethanoate Openeye Name: 1-[2-(bromomethyl)phenyl]heptyl acetate CAS Name: acetic acid 1-[2-(bromomethyl)phenyl]heptyl ester IUPAC Name: 1-[2-(bromomethyl)phenyl]heptyl acetate Traditional Name: acetic acid 1-[2-(bromomethyl)phenyl]heptyl ester Formula: C16H23BrO2 MolecularWeight: 327.25662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1CBr)OC(=O)C

Isomeric SMILES

CCCCCCC(C1=CC=CC=C1CBr)OC(=O)C

InChI

InChI=1S/C16H23BrO2/c1-3-4-5-6-11-16(19-13(2)18)15-10-8-7-9-14(15)12-17/h7-10,16H,3-6,11-12H2,1-2H3