[(E)-octadec-3-en-13-ynyl] ethanoate

Systemtic Name: [(E)-octadec-3-en-13-ynyl] ethanoate Openeye Name: [(E)-octadec-3-en-13-ynyl] acetate CAS Name: acetic acid [(E)-octadec-3-en-13-ynyl] ester IUPAC Name: [(E)-octadec-3-en-13-ynyl] acetate Traditional Name: acetic acid [(E)-octadec-3-en-13-ynyl] ester Formula: C20H34O2 MolecularWeight: 306.48276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCCCCCCCCC=CCCOC(=O)C

Isomeric SMILES

CCCCC#CCCCCCCCC/C=C/CCOC(=O)C

InChI

InChI=1S/C20H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h16-17H,3-5,8-15,18-19H2,1-2H3/b17-16+