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3-[(Z)-2-oxidanyloctadec-9-enoyl]oxypropane-1-sulfonic acid

3-[(Z)-2-oxidanyloctadec-9-enoyl]oxypropane-1-sulfonic acid

Systemtic Name:3-[(Z)-2-oxidanyloctadec-9-enoyl]oxypropane-1-sulfonic acid
Openeye Name:3-[(Z)-2-hydroxyoctadec-9-enoyl]oxypropane-1-sulfonic acid
CAS Name:3-[(Z)-2-hydroxy-1-oxooctadec-9-enoxy]-1-propanesulfonic acid
IUPAC Name:3-[(Z)-2-hydroxyoctadec-9-enoyl]oxypropane-1-sulfonic acid
Traditional Name:3-[(Z)-2-hydroxyoctadec-9-enoyl]oxypropane-1-sulfonic acid
Formula: C21H40O6S
MolecularWeight: 420.6037
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)OCCCS(=O)(=O)O)O


Isomeric SMILES

CCCCCCCC/C=C\CCCCCCC(C(=O)OCCCS(=O)(=O)O)O


InChI

InChI=1S/C21H40O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20(22)21(23)27-18-16-19-28(24,25)26/h9-10,20,22H,2-8,11-19H2,1H3,(H,24,25,26)/b10-9-


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