[(E)-1-cyanonon-1-en-3-yl] ethanoate

Systemtic Name: [(E)-1-cyanonon-1-en-3-yl] ethanoate Openeye Name: 1-[(E)-2-cyanovinyl]heptyl acetate CAS Name: acetic acid [(E)-1-cyanonon-1-en-3-yl] ester IUPAC Name: [(E)-1-cyanonon-1-en-3-yl] acetate Traditional Name: acetic acid [(E)-3-cyano-1-hexyl-allyl] ester Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C=CC#N)OC(=O)C

Isomeric SMILES

CCCCCCC(/C=C/C#N)OC(=O)C

InChI

InChI=1S/C12H19NO2/c1-3-4-5-6-8-12(9-7-10-13)15-11(2)14/h7,9,12H,3-6,8H2,1-2H3/b9-7+