1-(2,2-dimethylpropyl)-N,N-dihexyl-pyridin-1-ium-4-amine bromide

Systemtic Name: 1-(2,2-dimethylpropyl)-N,N-dihexyl-pyridin-1-ium-4-amine bromide Openeye Name: 1-(2,2-dimethylpropyl)-N,N-dihexyl-pyridin-1-ium-4-amine bromide CAS Name: 1-(2,2-dimethylpropyl)-N,N-dihexyl-4-pyridin-1-iumamine bromide IUPAC Name: 1-(2,2-dimethylpropyl)-N,N-dihexylpyridin-1-ium-4-amine bromide Traditional Name: dihexyl-(1-neopentylpyridin-1-ium-4-yl)amine bromide Formula: C22H41BrN2 MolecularWeight: 413.47834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC=[N+](C=C1)CC(C)(C)C.[Br-]

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC=[N+](C=C1)CC(C)(C)C.[Br-]

InChI

InChI=1S/C22H41N2.BrH/c1-6-8-10-12-16-24(17-13-11-9-7-2)21-14-18-23(19-15-21)20-22(3,4)5;/h14-15,18-19H,6-13,16-17,20H2,1-5H3;1H/q+1;/p-1