(3-bromophenyl)methyl icosanoate

Systemtic Name: (3-bromophenyl)methyl icosanoate Openeye Name: (3-bromophenyl)methyl icosanoate CAS Name: eicosanoic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl icosanoate Traditional Name: arachidic acid (3-bromobenzyl) ester Formula: C27H45BrO2 MolecularWeight: 481.549

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OCC1=CC(=CC=C1)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OCC1=CC(=CC=C1)Br

InChI

InChI=1S/C27H45BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-27(29)30-24-25-20-19-21-26(28)23-25/h19-21,23H,2-18,22,24H2,1H3