(1-cyano-2-methyl-prop-2-enyl) icosanoate

Systemtic Name: (1-cyano-2-methyl-prop-2-enyl) icosanoate Openeye Name: (1-cyano-2-methyl-allyl) icosanoate CAS Name: eicosanoic acid (1-cyano-2-methylprop-2-enyl) ester IUPAC Name: (1-cyano-2-methylprop-2-enyl) icosanoate Traditional Name: arachidic acid (1-cyano-2-methyl-allyl) ester Formula: C25H45NO2 MolecularWeight: 391.6303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OC(C#N)C(=C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OC(C#N)C(=C)C

InChI

InChI=1S/C25H45NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(27)28-24(22-26)23(2)3/h24H,2,4-21H2,1,3H3