disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfonatooxy-hex-4-enylidene]undeca-5,9-dienyl] sulfate

Systemtic Name: disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfonatooxy-hex-4-enylidene]undeca-5,9-dienyl] sulfate Openeye Name: disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfonatooxy-hex-4-enylidene]undeca-5,9-dienyl] sulfate CAS Name: disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfonatooxyhex-4-enylidene]undeca-5,9-dienyl] sulfate IUPAC Name: disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfonatooxyhex-4-enylidene]undeca-5,9-dienyl] sulfate Traditional Name: disodium [(2Z,5E)-6,10-dimethyl-2-[(E)-4-methyl-6-sulfato-hex-4-enylidene]undeca-5,9-dienyl] sulfate Formula: C20H32Na2O8S2 MolecularWeight: 510.57282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCCC(=CCOS(=O)(=O)[O-])C)COS(=O)(=O)[O-])C)C.[Na+].[Na+]

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CC/C(=C/COS(=O)(=O)[O-])/C)/COS(=O)(=O)[O-])/C)C.[Na+].[Na+]

InChI

InChI=1S/C20H34O8S2.2Na/c1-17(2)8-5-9-18(3)10-6-12-20(16-28-30(24,25)26)13-7-11-19(4)14-15-27-29(21,22)23;;/h8,10,13-14H,5-7,9,11-12,15-16H2,1-4H3,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b18-10+,19-14+,20-13-;;