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[(3Z,6Z,9Z)-henicosa-3,6,9-trienyl] methanesulfonate

[(3Z,6Z,9Z)-henicosa-3,6,9-trienyl] methanesulfonate

Systemtic Name:[(3Z,6Z,9Z)-henicosa-3,6,9-trienyl] methanesulfonate
Openeye Name:[(3Z,6Z,9Z)-henicosa-3,6,9-trienyl] methanesulfonate
CAS Name:methanesulfonic acid [(3Z,6Z,9Z)-heneicosa-3,6,9-trienyl] ester
IUPAC Name:[(3Z,6Z,9Z)-henicosa-3,6,9-trienyl] methanesulfonate
Traditional Name:methanesulfonic acid [(3Z,6Z,9Z)-heneicosa-3,6,9-trienyl] ester
Formula: C22H40O3S
MolecularWeight: 384.6162
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC=CCC=CCC=CCCOS(=O)(=O)C


Isomeric SMILES

CCCCCCCCCCC/C=C\C/C=C\C/C=C\CCOS(=O)(=O)C


InChI

InChI=1S/C22H40O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-26(2,23)24/h13-14,16-17,19-20H,3-12,15,18,21-22H2,1-2H3/b14-13-,17-16-,20-19-


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