[(E)-pent-2-en-4-ynyl] octanoate

Systemtic Name: [(E)-pent-2-en-4-ynyl] octanoate Openeye Name: [(E)-pent-2-en-4-ynyl] octanoate CAS Name: octanoic acid [(E)-pent-2-en-4-ynyl] ester IUPAC Name: [(E)-pent-2-en-4-ynyl] octanoate Traditional Name: caprylic acid [(E)-pent-2-en-4-ynyl] ester Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC=CC#C

Isomeric SMILES

CCCCCCCC(=O)OC/C=C/C#C

InChI

InChI=1S/C13H20O2/c1-3-5-7-8-9-11-13(14)15-12-10-6-4-2/h2,6,10H,3,5,7-9,11-12H2,1H3/b10-6+