hexadecyl-[2-[(3-methanoyl-2,2-dimethyl-1,3-thiazolidin-4-yl)carbonylamino]ethyl]-dimethyl-azanium chloride

Systemtic Name: hexadecyl-[2-[(3-methanoyl-2,2-dimethyl-1,3-thiazolidin-4-yl)carbonylamino]ethyl]-dimethyl-azanium chloride Openeye Name: 2-[(3-formyl-2,2-dimethyl-thiazolidine-4-carbonyl)amino]ethyl-hexadecyl-dimethyl-ammonium chloride CAS Name: 2-[[(3-formyl-2,2-dimethyl-4-thiazolidinyl)-oxomethyl]amino]ethyl-hexadecyl-dimethylammonium chloride IUPAC Name: 2-[(3-formyl-2,2-dimethyl-1,3-thiazolidine-4-carbonyl)amino]ethyl-hexadecyl-dimethylazanium chloride Traditional Name: cetyl-[2-[(3-formyl-2,2-dimethyl-thiazolidine-4-carbonyl)amino]ethyl]-dimethyl-ammonium chloride Formula: C27H54ClN3O2S MolecularWeight: 520.25456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCNC(=O)C1CSC(N1C=O)(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCNC(=O)C1CSC(N1C=O)(C)C.[Cl-]

InChI

InChI=1S/C27H53N3O2S.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-30(4,5)22-20-28-26(32)25-23-33-27(2,3)29(25)24-31;/h24-25H,6-23H2,1-5H3;1H