2-[bis[2,3-bis(oxidanyl)propyl]-hexadecyl-azaniumyl]ethanoate

Systemtic Name: 2-[bis[2,3-bis(oxidanyl)propyl]-hexadecyl-azaniumyl]ethanoate Openeye Name: 2-[bis(2,3-dihydroxypropyl)-hexadecyl-ammonio]acetate CAS Name: 2-[bis(2,3-dihydroxypropyl)-hexadecylammonio]acetate IUPAC Name: 2-[bis(2,3-dihydroxypropyl)-hexadecylazaniumyl]acetate Traditional Name: 2-[cetyl(diglyceryl)ammonio]acetate Formula: C24H49NO6 MolecularWeight: 447.64896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](CC(CO)O)(CC(CO)O)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](CC(CO)O)(CC(CO)O)CC(=O)[O-]

InChI

InChI=1S/C24H49NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(19-24(30)31,17-22(28)20-26)18-23(29)21-27/h22-23,26-29H,2-21H2,1H3