hexadecyl-(3-iodanylsulfonyloxypropyl)-dimethyl-azanium

Systemtic Name: hexadecyl-(3-iodanylsulfonyloxypropyl)-dimethyl-azanium Openeye Name: hexadecyl-(3-iodosulfonyloxypropyl)-dimethyl-ammonium CAS Name: hexadecyl-(3-iodosulfonyloxypropyl)-dimethylammonium IUPAC Name: hexadecyl-(3-iodosulfonyloxypropyl)-dimethylazanium Traditional Name: cetyl-(3-iodosulfonyloxypropyl)-dimethyl-ammonium Formula: C21H45INO3S+ MolecularWeight: 518.55637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOS(=O)(=O)I

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOS(=O)(=O)I

InChI

InChI=1S/C21H45INO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23(2,3)20-18-21-26-27(22,24)25/h4-21H2,1-3H3/q+1