1-(8-cyclopent-2-en-1-yloctyl)-4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium

Systemtic Name: 1-(8-cyclopent-2-en-1-yloctyl)-4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium Openeye Name: 1-(8-cyclopent-2-en-1-yloctyl)-4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium CAS Name: 1-[8-(1-cyclopent-2-enyl)octyl]-4-(1-phenyl-4-pyridin-1-iumyl)pyridin-1-ium IUPAC Name: 1-(8-cyclopent-2-en-1-yloctyl)-4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium Traditional Name: 1-(8-cyclopent-2-en-1-yloctyl)-4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium Formula: C29H36N2+2 MolecularWeight: 412.60954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C=C1)CCCCCCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(C=C1)CCCCCCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H36N2/c1(3-6-12-26-13-9-10-14-26)2-4-11-21-30-22-17-27(18-23-30)28-19-24-31(25-20-28)29-15-7-5-8-16-29/h5,7-9,13,15-20,22-26H,1-4,6,10-12,14,21H2/q+2