1-[6-(2,4-ditert-butylcyclopenta-2,4-dien-1-yl)hexyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium

Systemtic Name: 1-[6-(2,4-ditert-butylcyclopenta-2,4-dien-1-yl)hexyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Openeye Name: 1-[6-(2,4-ditert-butylcyclopenta-2,4-dien-1-yl)hexyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium CAS Name: 1-[6-(2,4-ditert-butyl-1-cyclopenta-2,4-dienyl)hexyl]-4-(1-methyl-4-pyridin-1-iumyl)pyridin-1-ium IUPAC Name: 1-[6-(2,4-ditert-butylcyclopenta-2,4-dien-1-yl)hexyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Traditional Name: 1-[6-(2,4-ditert-butylcyclopenta-2,4-dien-1-yl)hexyl]-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Formula: C30H44N2+2 MolecularWeight: 432.68376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(C(=C1)C(C)(C)C)CCCCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C

Isomeric SMILES

CC(C)(C)C1=CC(C(=C1)C(C)(C)C)CCCCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C

InChI

InChI=1S/C30H44N2/c1-29(2,3)27-22-26(28(23-27)30(4,5)6)12-10-8-9-11-17-32-20-15-25(16-21-32)24-13-18-31(7)19-14-24/h13-16,18-23,26H,8-12,17H2,1-7H3/q+2