[(2E)-3,7-dimethylocta-2,6-dienyl] 2-cyanoethanoate

Systemtic Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-cyanoethanoate Openeye Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-cyanoacetate CAS Name: 2-cyanoacetic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester IUPAC Name: [(2E)-3,7-dimethylocta-2,6-dienyl] 2-cyanoacetate Traditional Name: 2-cyanoacetic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOC(=O)CC#N)C)C

Isomeric SMILES

CC(=CCC/C(=C/COC(=O)CC#N)/C)C

InChI

InChI=1S/C13H19NO2/c1-11(2)5-4-6-12(3)8-10-16-13(15)7-9-14/h5,8H,4,6-7,10H2,1-3H3/b12-8+