[(2R,4S)-2,4-bis(oxidanyl)heptadec-16-ynyl] ethanoate

Systemtic Name: [(2R,4S)-2,4-bis(oxidanyl)heptadec-16-ynyl] ethanoate Openeye Name: [(2R,4S)-2,4-dihydroxyheptadec-16-ynyl] acetate CAS Name: acetic acid [(2R,4S)-2,4-dihydroxyheptadec-16-ynyl] ester IUPAC Name: [(2R,4S)-2,4-dihydroxyheptadec-16-ynyl] acetate Traditional Name: acetic acid [(2R,4S)-2,4-dihydroxyheptadec-16-ynyl] ester Formula: C19H34O4 MolecularWeight: 326.47086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC(CCCCCCCCCCCC#C)O)O

Isomeric SMILES

CC(=O)OC[C@@H](C[C@H](CCCCCCCCCCCC#C)O)O

InChI

InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,18-19,21-22H,4-16H2,2H3/t18-,19+/m0/s1