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

Systemtic Name: [3-[3-(decanoylamino)propyl]-2-methyl-pentadecan-2-yl]azanium chloride Openeye Name: [2-[3-(decanoylamino)propyl]-1,1-dimethyl-tetradecyl]ammonium chloride CAS Name: [2-methyl-3-[3-(1-oxodecylamino)propyl]pentadecan-2-yl]ammonium chloride IUPAC Name: [3-[3-(decanoylamino)propyl]-2-methylpentadecan-2-yl]azanium chloride Traditional Name: [2-[3-(caprylamino)propyl]-1,1-dimethyl-tetradecyl]ammonium chloride Formula: C29H61ClN2O MolecularWeight: 489.26044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H60N2O.ClH/c1-5-7-9-11-13-14-15-17-18-20-23-27(29(3,4)30)24-22-26-31-28(32)25-21-19-16-12-10-8-6-2;/h27H,5-26,30H2,1-4H3,(H,31,32);1H