1-[(4-methylphenyl)methyl]-4-nonan-5-yl-pyridin-1-ium chloride

Systemtic Name: 1-[(4-methylphenyl)methyl]-4-nonan-5-yl-pyridin-1-ium chloride Openeye Name: 4-(1-butylpentyl)-1-(p-tolylmethyl)pyridin-1-ium chloride CAS Name: 1-[(4-methylphenyl)methyl]-4-nonan-5-ylpyridin-1-ium chloride IUPAC Name: 1-[(4-methylphenyl)methyl]-4-nonan-5-ylpyridin-1-ium chloride Traditional Name: 4-(1-butylpentyl)-1-(4-methylbenzyl)pyridin-1-ium chloride Formula: C22H32ClN MolecularWeight: 345.94918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C.[Cl-]

Isomeric SMILES

CCCCC(CCCC)C1=CC=[N+](C=C1)CC2=CC=C(C=C2)C.[Cl-]

InChI

InChI=1S/C22H32N.ClH/c1-4-6-8-21(9-7-5-2)22-14-16-23(17-15-22)18-20-12-10-19(3)11-13-20;/h10-17,21H,4-9,18H2,1-3H3;1H/q+1;/p-1