hexadecyl-(2-hydroxyethyl)-methyl-(2-oxidanyl-4-sulfo-butyl)azanium

Systemtic Name: hexadecyl-(2-hydroxyethyl)-methyl-(2-oxidanyl-4-sulfo-butyl)azanium Openeye Name: hexadecyl-(2-hydroxyethyl)-(2-hydroxy-4-sulfo-butyl)-methyl-ammonium CAS Name: hexadecyl-(2-hydroxyethyl)-(2-hydroxy-4-sulfobutyl)-methylammonium IUPAC Name: hexadecyl-(2-hydroxyethyl)-(2-hydroxy-4-sulfobutyl)-methylazanium Traditional Name: cetyl-(2-hydroxyethyl)-(2-hydroxy-4-sulfo-butyl)-methyl-ammonium Formula: C23H50NO5S+ MolecularWeight: 452.7118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(CCO)CC(CCS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(CCO)CC(CCS(=O)(=O)O)O

InChI

InChI=1S/C23H49NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24(2,19-20-25)22-23(26)17-21-30(27,28)29/h23,25-26H,3-22H2,1-2H3/p+1