2,3-bis(oxidanyl)propanethioyl (E)-octadec-9-enoate

Systemtic Name: 2,3-bis(oxidanyl)propanethioyl (E)-octadec-9-enoate Openeye Name: 2,3-dihydroxypropanethioyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid (2,3-dihydroxy-1-sulfanylidenepropyl) ester IUPAC Name: 2,3-dihydroxypropanethioyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 2,3-dihydroxypropanethioyl ester Formula: C21H38O4S MolecularWeight: 386.58902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(=S)C(CO)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(=S)C(CO)O

InChI

InChI=1S/C21H38O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)25-21(26)19(23)18-22/h9-10,19,22-23H,2-8,11-18H2,1H3/b10-9+