4-[4-[1-(4-cyclopenta-1,4-dien-1-ylbutyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]butan-1-ol

Systemtic Name: 4-[4-[1-(4-cyclopenta-1,4-dien-1-ylbutyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]butan-1-ol Openeye Name: 4-[4-[1-(4-cyclopenta-1,4-dien-1-ylbutyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]butan-1-ol CAS Name: 4-[4-[1-[4-(1-cyclopenta-1,4-dienyl)butyl]-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]-1-butanol IUPAC Name: 4-[4-[1-(4-cyclopenta-1,4-dien-1-ylbutyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]butan-1-ol Traditional Name: 4-[4-[1-(4-cyclopenta-1,4-dien-1-ylbutyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]butan-1-ol Formula: C23H30N2O+2 MolecularWeight: 350.4971

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=C1)CCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CCCCO

Isomeric SMILES

C1C=CC(=C1)CCCC[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CCCCO

InChI

InChI=1S/C23H30N2O/c26-20-6-5-15-25-18-12-23(13-19-25)22-10-16-24(17-11-22)14-4-3-9-21-7-1-2-8-21/h1,7-8,10-13,16-19,26H,2-6,9,14-15,20H2/q+2