4-[2-[hexadecoxy(methylsulfonyloxy)methyl]prop-2-enoxy]butyl-trimethyl-azanium

Systemtic Name: 4-[2-[hexadecoxy(methylsulfonyloxy)methyl]prop-2-enoxy]butyl-trimethyl-azanium Openeye Name: 4-[2-[hexadecoxy(methylsulfonyloxy)methyl]allyloxy]butyl-trimethyl-ammonium CAS Name: 4-[2-[hexadecoxy(methylsulfonyloxy)methyl]prop-2-enoxy]butyl-trimethylammonium IUPAC Name: 4-[2-[hexadecoxy(methylsulfonyloxy)methyl]prop-2-enoxy]butyl-trimethylazanium Traditional Name: 4-[2-[cetyloxy(methylsulfonyloxy)methyl]allyloxy]butyl-trimethyl-ammonium Formula: C28H58NO5S+ MolecularWeight: 520.82882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C(=C)COCCCC[N+](C)(C)C)OS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C(=C)COCCCC[N+](C)(C)C)OS(=O)(=O)C

InChI

InChI=1S/C28H58NO5S/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-33-28(34-35(6,30)31)27(2)26-32-24-22-20-23-29(3,4)5/h28H,2,7-26H2,1,3-6H3/q+1