dimethyl-(naphthalen-1-ylmethyl)-(2-octadecanoyloxyethyl)azanium chloride

Systemtic Name: dimethyl-(naphthalen-1-ylmethyl)-(2-octadecanoyloxyethyl)azanium chloride Openeye Name: dimethyl-(1-naphthylmethyl)-(2-octadecanoyloxyethyl)ammonium chloride CAS Name: dimethyl-(1-naphthalenylmethyl)-[2-(1-oxooctadecoxy)ethyl]ammonium chloride IUPAC Name: dimethyl-(naphthalen-1-ylmethyl)-(2-octadecanoyloxyethyl)azanium chloride Traditional Name: dimethyl-(1-naphthylmethyl)-(2-stearoyloxyethyl)ammonium chloride Formula: C33H54ClNO2 MolecularWeight: 532.24036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CC1=CC=CC2=CC=CC=C21.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CC1=CC=CC2=CC=CC=C21.[Cl-]

InChI

InChI=1S/C33H54NO2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-33(35)36-28-27-34(2,3)29-31-24-21-23-30-22-19-20-25-32(30)31;/h19-25H,4-18,26-29H2,1-3H3;1H/q+1;/p-1