ethyl (4S,5R)-5-pentadec-12-ynyl-2-sulfanylidene-1,3-dioxolane-4-carboxylate

Systemtic Name: ethyl (4S,5R)-5-pentadec-12-ynyl-2-sulfanylidene-1,3-dioxolane-4-carboxylate Openeye Name: ethyl (4S,5R)-5-pentadec-12-ynyl-2-thioxo-1,3-dioxolane-4-carboxylate CAS Name: (4S,5R)-5-pentadec-12-ynyl-2-sulfanylidene-1,3-dioxolane-4-carboxylic acid ethyl ester IUPAC Name: ethyl (4S,5R)-5-pentadec-12-ynyl-2-sulfanylidene-1,3-dioxolane-4-carboxylate Traditional Name: (4S,5R)-5-pentadec-12-ynyl-2-thioxo-1,3-dioxolane-4-carboxylic acid ethyl ester Formula: C21H34O4S MolecularWeight: 382.55726

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCCCCCCCCCCC1C(OC(=S)O1)C(=O)OCC

Isomeric SMILES

CCC#CCCCCCCCCCCC[C@@H]1[C@H](OC(=S)O1)C(=O)OCC

InChI

InChI=1S/C21H34O4S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20(22)23-4-2)25-21(26)24-18/h18-19H,3-4,7-17H2,1-2H3/t18-,19+/m1/s1