2-methoxydocosyl-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium

Systemtic Name: 2-methoxydocosyl-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium Openeye Name: (2-hydroxy-3-sulfo-propyl)-(2-methoxydocosyl)-dimethyl-ammonium CAS Name: (2-hydroxy-3-sulfopropyl)-(2-methoxydocosyl)-dimethylammonium IUPAC Name: (2-hydroxy-3-sulfopropyl)-(2-methoxydocosyl)-dimethylazanium Traditional Name: (2-hydroxy-3-sulfo-propyl)-(2-methoxydocosyl)-dimethyl-ammonium Formula: C28H60NO5S+ MolecularWeight: 522.8447

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C[N+](C)(C)CC(CS(=O)(=O)O)O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C[N+](C)(C)CC(CS(=O)(=O)O)O)OC

InChI

InChI=1S/C28H59NO5S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28(34-4)25-29(2,3)24-27(30)26-35(31,32)33/h27-28,30H,5-26H2,1-4H3/p+1