2-[(E)-octadec-9-enoyl]sulfanyl-2-oxidanyl-ethanoate

Systemtic Name: 2-[(E)-octadec-9-enoyl]sulfanyl-2-oxidanyl-ethanoate Openeye Name: 2-hydroxy-2-[(E)-octadec-9-enoyl]sulfanyl-acetate CAS Name: 2-hydroxy-2-[[(E)-1-oxooctadec-9-enyl]thio]acetate IUPAC Name: 2-hydroxy-2-[(E)-octadec-9-enoyl]sulfanylacetate Traditional Name: 2-hydroxy-2-[[(E)-octadec-9-enoyl]thio]acetate Formula: C20H35O4S- MolecularWeight: 371.5545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)SC(C(=O)[O-])O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)SC(C(=O)[O-])O

InChI

InChI=1S/C20H36O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(21)25-20(24)19(22)23/h9-10,20,24H,2-8,11-17H2,1H3,(H,22,23)/p-1/b10-9+