(3,4-dimethylphenyl)methyl icosanoate

Systemtic Name: (3,4-dimethylphenyl)methyl icosanoate Openeye Name: (3,4-dimethylphenyl)methyl icosanoate CAS Name: eicosanoic acid (3,4-dimethylphenyl)methyl ester IUPAC Name: (3,4-dimethylphenyl)methyl icosanoate Traditional Name: arachidic acid (3,4-dimethylbenzyl) ester Formula: C29H50O2 MolecularWeight: 430.7061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H50O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29(30)31-25-28-23-22-26(2)27(3)24-28/h22-24H,4-21,25H2,1-3H3