1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)pyridin-1-ium-4-yl]pyridin-1-ium

Systemtic Name: 1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)pyridin-1-ium-4-yl]pyridin-1-ium Openeye Name: 1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)pyridin-1-ium-4-yl]pyridin-1-ium CAS Name: 1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)-4-pyridin-1-iumyl]pyridin-1-ium IUPAC Name: 1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)pyridin-1-ium-4-yl]pyridin-1-ium Traditional Name: 1-(2,5-dimethylheptyl)-4-[1-(3,6-dimethyloctyl)pyridin-1-ium-4-yl]pyridin-1-ium Formula: C29H48N2+2 MolecularWeight: 424.70482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H48N2/c1-7-24(3)9-11-26(5)13-18-30-19-14-28(15-20-30)29-16-21-31(22-17-29)23-27(6)12-10-25(4)8-2/h14-17,19-22,24-27H,7-13,18,23H2,1-6H3/q+2