[6,10-dimethyl-2-(4-methylpentyl)-11-sulfooxy-undecyl] hydrogen sulfate

Systemtic Name: [6,10-dimethyl-2-(4-methylpentyl)-11-sulfooxy-undecyl] hydrogen sulfate Openeye Name: (2-isohexyl-6,10-dimethyl-11-sulfooxy-undecyl) hydrogen sulfate CAS Name: sulfuric acid [6,10-dimethyl-2-(4-methylpentyl)-11-sulfooxyundecyl] ester IUPAC Name: [6,10-dimethyl-2-(4-methylpentyl)-11-sulfooxyundecyl] hydrogen sulfate Traditional Name: sulfuric acid (2-isohexyl-6,10-dimethyl-11-sulfoxy-undecyl) ester Formula: C19H40O8S2 MolecularWeight: 460.6461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(CCCC(C)CCCC(C)COS(=O)(=O)O)COS(=O)(=O)O

Isomeric SMILES

CC(C)CCCC(CCCC(C)CCCC(C)COS(=O)(=O)O)COS(=O)(=O)O

InChI

InChI=1S/C19H40O8S2/c1-16(2)8-5-12-19(15-27-29(23,24)25)13-7-10-17(3)9-6-11-18(4)14-26-28(20,21)22/h16-19H,5-15H2,1-4H3,(H,20,21,22)(H,23,24,25)