hexadecyl-dimethyl-(3-phosphonooxypropyl)azanium

Systemtic Name: hexadecyl-dimethyl-(3-phosphonooxypropyl)azanium Openeye Name: hexadecyl-dimethyl-(3-phosphonooxypropyl)ammonium CAS Name: hexadecyl-dimethyl-(3-phosphonooxypropyl)ammonium IUPAC Name: hexadecyl-dimethyl-(3-phosphonooxypropyl)azanium Traditional Name: cetyl-dimethyl-(3-phosphonooxypropyl)ammonium Formula: C21H47NO4P+ MolecularWeight: 408.575941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCOP(=O)(O)O

InChI

InChI=1S/C21H46NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-26-27(23,24)25/h4-21H2,1-3H3,(H-,23,24,25)/p+1