2-dodecanoyloxyethyl-(2-hydroxyethyl)-methyl-(phenylmethyl)azanium chloride

Systemtic Name: 2-dodecanoyloxyethyl-(2-hydroxyethyl)-methyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-(2-dodecanoyloxyethyl)-(2-hydroxyethyl)-methyl-ammonium chloride CAS Name: 2-hydroxyethyl-methyl-[2-(1-oxododecoxy)ethyl]-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-(2-dodecanoyloxyethyl)-(2-hydroxyethyl)-methylazanium chloride Traditional Name: benzyl-(2-hydroxyethyl)-(2-lauroyloxyethyl)-methyl-ammonium chloride Formula: C24H42ClNO3 MolecularWeight: 428.04818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC[N+](C)(CCO)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC[N+](C)(CCO)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C24H42NO3.ClH/c1-3-4-5-6-7-8-9-10-14-17-24(27)28-21-19-25(2,18-20-26)22-23-15-12-11-13-16-23;/h11-13,15-16,26H,3-10,14,17-22H2,1-2H3;1H/q+1;/p-1