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butyl-(2-chloroethyl)-dioctadecyl-azanium

butyl-(2-chloroethyl)-dioctadecyl-azanium

Systemtic Name:butyl-(2-chloroethyl)-dioctadecyl-azanium
Openeye Name:butyl-(2-chloroethyl)-dioctadecyl-ammonium
CAS Name:butyl-(2-chloroethyl)-dioctadecylammonium
IUPAC Name:butyl-(2-chloroethyl)-dioctadecylazanium
Traditional Name:butyl-(2-chloroethyl)-distearyl-ammonium
Formula: C42H87ClN+
MolecularWeight: 641.59988
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CCCC)(CCCCCCCCCCCCCCCCCC)CCCl


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CCCC)(CCCCCCCCCCCCCCCCCC)CCCl


InChI

InChI=1S/C42H87ClN/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-40-44(42-38-43,39-9-6-3)41-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h4-42H2,1-3H3/q+1


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