3-[2,3-bis(oxidanyl)propoxy-(dioxidanyl)phosphoryl]oxypropyl-hexadecyl-dimethyl-azanium

Systemtic Name: 3-[2,3-bis(oxidanyl)propoxy-(dioxidanyl)phosphoryl]oxypropyl-hexadecyl-dimethyl-azanium Openeye Name: 3-[2,3-dihydroxypropoxy(hydroperoxy)phosphoryl]oxypropyl-hexadecyl-dimethyl-ammonium CAS Name: 3-[2,3-dihydroxypropoxy(hydroperoxy)phosphoryl]oxypropyl-hexadecyl-dimethylammonium IUPAC Name: 3-[2,3-dihydroxypropoxy(hydroperoxy)phosphoryl]oxypropyl-hexadecyl-dimethylazanium Traditional Name: cetyl-[3-[glyceryloxy(hydroperoxy)phosphoryl]oxypropyl]-dimethyl-ammonium Formula: C24H53NO7P+ MolecularWeight: 498.653881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOP(=O)(OCC(CO)O)OO

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOP(=O)(OCC(CO)O)OO

InChI

InChI=1S/C24H52NO7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-25(2,3)20-18-21-30-33(29,32-28)31-23-24(27)22-26/h24,26-27H,4-23H2,1-3H3/p+1