methyl 4-[4-[1-(cyclopenta-1,4-dien-1-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]benzoate

Systemtic Name: methyl 4-[4-[1-(cyclopenta-1,4-dien-1-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]benzoate Openeye Name: methyl 4-[4-[1-(cyclopenta-1,4-dien-1-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]benzoate CAS Name: 4-[4-[1-(1-cyclopenta-1,4-dienylmethyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[1-(cyclopenta-1,4-dien-1-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]benzoate Traditional Name: 4-[4-[1-(cyclopenta-1,4-dien-1-ylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]benzoic acid methyl ester Formula: C24H22N2O2+2 MolecularWeight: 370.44368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC4=CCC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC4=CCC=C4

InChI

InChI=1S/C24H22N2O2/c1-28-24(27)22-6-8-23(9-7-22)26-16-12-21(13-17-26)20-10-14-25(15-11-20)18-19-4-2-3-5-19/h2,4-17H,3,18H2,1H3/q+2