(5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid

Systemtic Name: (5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid Openeye Name: (5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid CAS Name: (5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-1-pentadeca-5,9,13-trienesulfonic acid IUPAC Name: (5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethylpentadeca-5,9,13-triene-1-sulfonic acid Traditional Name: (5Z,9E)-1-diethoxyphosphoryl-6,10,14-trimethyl-pentadeca-5,9,13-triene-1-sulfonic acid Formula: C22H41O6PS MolecularWeight: 464.596101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCC=C(C)CCC=C(C)CCC=C(C)C)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CCC/C=C(/C)\CC/C=C(\C)/CCC=C(C)C)S(=O)(=O)O)OCC

InChI

InChI=1S/C22H41O6PS/c1-7-27-29(23,28-8-2)22(30(24,25)26)18-10-9-14-20(5)16-12-17-21(6)15-11-13-19(3)4/h13-14,17,22H,7-12,15-16,18H2,1-6H3,(H,24,25,26)/b20-14-,21-17+