docosyl-ethyl-methyl-(2-oxidanyl-3-sulfo-propyl)azanium

Systemtic Name: docosyl-ethyl-methyl-(2-oxidanyl-3-sulfo-propyl)azanium Openeye Name: docosyl-ethyl-(2-hydroxy-3-sulfo-propyl)-methyl-ammonium CAS Name: docosyl-ethyl-(2-hydroxy-3-sulfopropyl)-methylammonium IUPAC Name: docosyl-ethyl-(2-hydroxy-3-sulfopropyl)-methylazanium Traditional Name: behenyl-ethyl-(2-hydroxy-3-sulfo-propyl)-methyl-ammonium Formula: C28H60NO4S+ MolecularWeight: 506.8453

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(CC)CC(CS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(CC)CC(CS(=O)(=O)O)O

InChI

InChI=1S/C28H59NO4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29(3,5-2)26-28(30)27-34(31,32)33/h28,30H,4-27H2,1-3H3/p+1