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docosyl-dimethyl-(phenylmethyl)azanium chloride

docosyl-dimethyl-(phenylmethyl)azanium chloride

Systemtic Name:docosyl-dimethyl-(phenylmethyl)azanium chloride
Openeye Name:benzyl-docosyl-dimethyl-ammonium chloride
CAS Name:docosyl-dimethyl-(phenylmethyl)ammonium chloride
IUPAC Name:benzyl-docosyl-dimethylazanium chloride
Traditional Name:behenyl-benzyl-dimethyl-ammonium chloride
Formula: C31H58ClN
MolecularWeight: 480.25192
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]


InChI

InChI=1S/C31H58N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-32(2,3)30-31-27-24-23-25-28-31;/h23-25,27-28H,4-22,26,29-30H2,1-3H3;1H/q+1;/p-1


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