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(2-ethenylphenyl)methyl-trihexyl-azanium chloride

(2-ethenylphenyl)methyl-trihexyl-azanium chloride

Systemtic Name:(2-ethenylphenyl)methyl-trihexyl-azanium chloride
Openeye Name:trihexyl-[(2-vinylphenyl)methyl]ammonium chloride
CAS Name:(2-ethenylphenyl)methyl-trihexylammonium chloride
IUPAC Name:(2-ethenylphenyl)methyl-trihexylazanium chloride
Traditional Name:trihexyl-(2-vinylbenzyl)ammonium chloride
Formula: C27H48ClN
MolecularWeight: 422.12972
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](CCCCCC)(CCCCCC)CC1=CC=CC=C1C=C.[Cl-]


Isomeric SMILES

CCCCCC[N+](CCCCCC)(CCCCCC)CC1=CC=CC=C1C=C.[Cl-]


InChI

InChI=1S/C27H48N.ClH/c1-5-9-12-17-22-28(23-18-13-10-6-2,24-19-14-11-7-3)25-27-21-16-15-20-26(27)8-4;/h8,15-16,20-21H,4-7,9-14,17-19,22-25H2,1-3H3;1H/q+1;/p-1


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