1-(cyclopenta-1,4-dien-1-ylmethyl)-4-(1-pyridin-4-ylpyridin-1-ium-4-yl)pyridin-1-ium

Systemtic Name: 1-(cyclopenta-1,4-dien-1-ylmethyl)-4-(1-pyridin-4-ylpyridin-1-ium-4-yl)pyridin-1-ium Openeye Name: 1-(cyclopenta-1,4-dien-1-ylmethyl)-4-[1-(4-pyridyl)pyridin-1-ium-4-yl]pyridin-1-ium CAS Name: 1-(1-cyclopenta-1,4-dienylmethyl)-4-(1-pyridin-4-yl-4-pyridin-1-iumyl)pyridin-1-ium IUPAC Name: 1-(cyclopenta-1,4-dien-1-ylmethyl)-4-(1-pyridin-4-ylpyridin-1-ium-4-yl)pyridin-1-ium Traditional Name: 1-(cyclopenta-1,4-dien-1-ylmethyl)-4-[1-(4-pyridyl)pyridin-1-ium-4-yl]pyridin-1-ium Formula: C21H19N3+2 MolecularWeight: 313.39566

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=C1)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C4=CC=NC=C4

Isomeric SMILES

C1C=CC(=C1)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C4=CC=NC=C4

InChI

InChI=1S/C21H19N3/c1-2-4-18(3-1)17-23-13-7-19(8-14-23)20-9-15-24(16-10-20)21-5-11-22-12-6-21/h1,3-16H,2,17H2/q+2