3-(octadecanoylamino)propyl-pentan-3-yl-azanium chloride

Systemtic Name: 3-(octadecanoylamino)propyl-pentan-3-yl-azanium chloride Openeye Name: 1-ethylpropyl-[3-(octadecanoylamino)propyl]ammonium chloride CAS Name: 3-(1-oxooctadecylamino)propyl-pentan-3-ylammonium chloride IUPAC Name: 3-(octadecanoylamino)propyl-pentan-3-ylazanium chloride Traditional Name: 1-ethylpropyl(3-stearamidopropyl)ammonium chloride Formula: C26H55ClN2O MolecularWeight: 447.1807

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]C(CC)CC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCC[NH2+]C(CC)CC.[Cl-]

InChI

InChI=1S/C26H54N2O.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-26(29)28-24-21-23-27-25(5-2)6-3;/h25,27H,4-24H2,1-3H3,(H,28,29);1H