[3-[3-(dodecanoylamino)propyl]-2-methyl-pentadecan-2-yl]azanium chloride

Systemtic Name: [3-[3-(dodecanoylamino)propyl]-2-methyl-pentadecan-2-yl]azanium chloride Openeye Name: [2-[3-(dodecanoylamino)propyl]-1,1-dimethyl-tetradecyl]ammonium chloride CAS Name: [2-methyl-3-[3-(1-oxododecylamino)propyl]pentadecan-2-yl]ammonium chloride IUPAC Name: [3-[3-(dodecanoylamino)propyl]-2-methylpentadecan-2-yl]azanium chloride Traditional Name: [2-[3-(lauroylamino)propyl]-1,1-dimethyl-tetradecyl]ammonium chloride Formula: C31H65ClN2O MolecularWeight: 517.3136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCNC(=O)CCCCCCCCCCC)C(C)(C)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(CCCNC(=O)CCCCCCCCCCC)C(C)(C)[NH3+].[Cl-]

InChI

InChI=1S/C31H64N2O.ClH/c1-5-7-9-11-13-15-17-18-20-22-25-29(31(3,4)32)26-24-28-33-30(34)27-23-21-19-16-14-12-10-8-6-2;/h29H,5-28,32H2,1-4H3,(H,33,34);1H