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(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid

(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid

Systemtic Name:(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid
Openeye Name:(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid
CAS Name:(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid
IUPAC Name:(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid
Traditional Name:(9Z,12E)-12-sulfooctadeca-9,12-dienoic acid
Formula: C18H32O5S
MolecularWeight: 360.50868
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(CC=CCCCCCCCC(=O)O)S(=O)(=O)O


Isomeric SMILES

CCCCC/C=C(\C/C=C\CCCCCCCC(=O)O)/S(=O)(=O)O


InChI

InChI=1S/C18H32O5S/c1-2-3-4-11-14-17(24(21,22)23)15-12-9-7-5-6-8-10-13-16-18(19)20/h9,12,14H,2-8,10-11,13,15-16H2,1H3,(H,19,20)(H,21,22,23)/b12-9-,17-14+


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