2-cyclopenta-1,4-dien-1-yl-N-[2-[4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethyl]ethanamine

Systemtic Name: 2-cyclopenta-1,4-dien-1-yl-N-[2-[4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethyl]ethanamine Openeye Name: 2-cyclopenta-1,4-dien-1-yl-N-[2-[4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethyl]ethanamine CAS Name: 2-(1-cyclopenta-1,4-dienyl)-N-[2-[4-(1-phenyl-4-pyridin-1-iumyl)-1-pyridin-1-iumyl]ethyl]ethanamine IUPAC Name: 2-cyclopenta-1,4-dien-1-yl-N-[2-[4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethyl]ethanamine Traditional Name: 2-cyclopenta-1,4-dien-1-ylethyl-[2-[4-(1-phenylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]ethyl]amine Formula: C25H27N3+2 MolecularWeight: 369.50198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3/c1-2-8-25(9-3-1)28-19-13-24(14-20-28)23-11-17-27(18-12-23)21-16-26-15-10-22-6-4-5-7-22/h1-4,6-9,11-14,17-20,26H,5,10,15-16,21H2/q+2