2,3-bis(oxidanyl)propyl-[1-(docosanoylamino)propyl]-dimethyl-azanium chloride

Systemtic Name: 2,3-bis(oxidanyl)propyl-[1-(docosanoylamino)propyl]-dimethyl-azanium chloride Openeye Name: 2,3-dihydroxypropyl-[1-(docosanoylamino)propyl]-dimethyl-ammonium chloride CAS Name: 2,3-dihydroxypropyl-dimethyl-[1-(1-oxodocosylamino)propyl]ammonium chloride IUPAC Name: 2,3-dihydroxypropyl-[1-(docosanoylamino)propyl]-dimethylazanium chloride Traditional Name: 1-(docosanoylamino)propyl-glyceryl-dimethyl-ammonium chloride Formula: C30H63ClN2O3 MolecularWeight: 535.28582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)[N+](C)(C)CC(CO)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC)[N+](C)(C)CC(CO)O.[Cl-]

InChI

InChI=1S/C30H62N2O3.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-30(35)31-29(6-2)32(3,4)26-28(34)27-33;/h28-29,33-34H,5-27H2,1-4H3;1H