N,N-dibutyl-1-(2-ethylhexyl)pyridin-1-ium-4-amine bromide

Systemtic Name: N,N-dibutyl-1-(2-ethylhexyl)pyridin-1-ium-4-amine bromide Openeye Name: N,N-dibutyl-1-(2-ethylhexyl)pyridin-1-ium-4-amine bromide CAS Name: N,N-dibutyl-1-(2-ethylhexyl)-4-pyridin-1-iumamine bromide IUPAC Name: N,N-dibutyl-1-(2-ethylhexyl)pyridin-1-ium-4-amine bromide Traditional Name: dibutyl-[1-(2-ethylhexyl)pyridin-1-ium-4-yl]amine bromide Formula: C21H39BrN2 MolecularWeight: 399.45176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[N+]1=CC=C(C=C1)N(CCCC)CCCC.[Br-]

Isomeric SMILES

CCCCC(CC)C[N+]1=CC=C(C=C1)N(CCCC)CCCC.[Br-]

InChI

InChI=1S/C21H39N2.BrH/c1-5-9-12-20(8-4)19-22-17-13-21(14-18-22)23(15-10-6-2)16-11-7-3;/h13-14,17-18,20H,5-12,15-16,19H2,1-4H3;1H/q+1;/p-1