[1,2-bis(oxidanyl)-2-oxidanylidene-1-sulfo-ethyl]-dimethyl-(2-methyltetradecan-2-yl)azanium

Systemtic Name: [1,2-bis(oxidanyl)-2-oxidanylidene-1-sulfo-ethyl]-dimethyl-(2-methyltetradecan-2-yl)azanium Openeye Name: (1,2-dihydroxy-2-oxo-1-sulfo-ethyl)-(1,1-dimethyltridecyl)-dimethyl-ammonium CAS Name: (1,2-dihydroxy-2-oxo-1-sulfoethyl)-dimethyl-(2-methyltetradecan-2-yl)ammonium IUPAC Name: (1,2-dihydroxy-2-oxo-1-sulfoethyl)-dimethyl-(2-methyltetradecan-2-yl)azanium Traditional Name: (1,2-dihydroxy-2-keto-1-sulfo-ethyl)-(1,1-dimethyltridecyl)-dimethyl-ammonium Formula: C19H40NO6S+ MolecularWeight: 410.589

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)(C)[N+](C)(C)C(C(=O)O)(O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(C)(C)[N+](C)(C)C(C(=O)O)(O)S(=O)(=O)O

InChI

InChI=1S/C19H39NO6S/c1-6-7-8-9-10-11-12-13-14-15-16-18(2,3)20(4,5)19(23,17(21)22)27(24,25)26/h23H,6-16H2,1-5H3,(H-,21,22,24,25,26)/p+1