3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-hexadecyl-dimethyl-azanium bromide

Systemtic Name: 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]propyl-hexadecyl-dimethyl-azanium bromide Openeye Name: 3-(2,5-dioxopyrrolidin-1-yl)propyl-hexadecyl-dimethyl-ammonium bromide CAS Name: 3-(2,5-dioxo-1-pyrrolidinyl)propyl-hexadecyl-dimethylammonium bromide IUPAC Name: 3-(2,5-dioxopyrrolidin-1-yl)propyl-hexadecyl-dimethylazanium bromide Traditional Name: cetyl-dimethyl-(3-succinimidopropyl)ammonium bromide Formula: C25H49BrN2O2 MolecularWeight: 489.57276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCN1C(=O)CCC1=O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCN1C(=O)CCC1=O.[Br-]

InChI

InChI=1S/C25H49N2O2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-27(2,3)23-18-21-26-24(28)19-20-25(26)29;/h4-23H2,1-3H3;1H/q+1;/p-1