(E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)non-5-ene-1-sulfonic acid

Systemtic Name: (E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)non-5-ene-1-sulfonic acid Openeye Name: (E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)non-5-ene-1-sulfonic acid CAS Name: (E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)-5-nonene-1-sulfonic acid IUPAC Name: (E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)non-5-ene-1-sulfonic acid Traditional Name: (E)-1-diethoxyphosphoryl-6-methyl-9-(4-propylphenyl)non-5-ene-1-sulfonic acid Formula: C23H39O6PS MolecularWeight: 474.590921

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CCCC(=CCCCC(P(=O)(OCC)OCC)S(=O)(=O)O)C

Isomeric SMILES

CCCC1=CC=C(C=C1)CCC/C(=C/CCCC(P(=O)(OCC)OCC)S(=O)(=O)O)/C

InChI

InChI=1S/C23H39O6PS/c1-5-11-21-16-18-22(19-17-21)14-10-13-20(4)12-8-9-15-23(31(25,26)27)30(24,28-6-2)29-7-3/h12,16-19,23H,5-11,13-15H2,1-4H3,(H,25,26,27)/b20-12+