(3,3,4-trimethyl-2-sulfooxy-hexadecan-2-yl) sulfate

Systemtic Name: (3,3,4-trimethyl-2-sulfooxy-hexadecan-2-yl) sulfate Openeye Name: (1,2,2,3-tetramethyl-1-sulfooxy-pentadecyl) sulfate CAS Name: (3,3,4-trimethyl-2-sulfooxyhexadecan-2-yl) sulfate IUPAC Name: (3,3,4-trimethyl-2-sulfooxyhexadecan-2-yl) sulfate Traditional Name: (1,2,2,3-tetramethyl-1-sulfoxy-pentadecyl) sulfate Formula: C19H39O8S2- MolecularWeight: 459.63816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C(C)(C)C(C)(OS(=O)(=O)O)OS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC(C)C(C)(C)C(C)(OS(=O)(=O)O)OS(=O)(=O)[O-]

InChI

InChI=1S/C19H40O8S2/c1-6-7-8-9-10-11-12-13-14-15-16-17(2)18(3,4)19(5,26-28(20,21)22)27-29(23,24)25/h17H,6-16H2,1-5H3,(H,20,21,22)(H,23,24,25)/p-1