1-methyl-4-[1-(2,5,5-trimethylheptyl)pyridin-1-ium-4-yl]pyridin-1-ium

Systemtic Name: 1-methyl-4-[1-(2,5,5-trimethylheptyl)pyridin-1-ium-4-yl]pyridin-1-ium Openeye Name: 1-methyl-4-[1-(2,5,5-trimethylheptyl)pyridin-1-ium-4-yl]pyridin-1-ium CAS Name: 1-methyl-4-[1-(2,5,5-trimethylheptyl)-4-pyridin-1-iumyl]pyridin-1-ium IUPAC Name: 1-methyl-4-[1-(2,5,5-trimethylheptyl)pyridin-1-ium-4-yl]pyridin-1-ium Traditional Name: 1-methyl-4-[1-(2,5,5-trimethylheptyl)pyridin-1-ium-4-yl]pyridin-1-ium Formula: C21H32N2+2 MolecularWeight: 312.49218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CCC(C)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C

Isomeric SMILES

CCC(C)(C)CCC(C)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C

InChI

InChI=1S/C21H32N2/c1-6-21(3,4)12-7-18(2)17-23-15-10-20(11-16-23)19-8-13-22(5)14-9-19/h8-11,13-16,18H,6-7,12,17H2,1-5H3/q+2