[phenyl-[4-[1-(3-propylphenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phosphonic acid

Systemtic Name: [phenyl-[4-[1-(3-propylphenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phosphonic acid Openeye Name: [phenyl-[4-[1-(3-propylphenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phosphonic acid CAS Name: [phenyl-[4-[1-(3-propylphenyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]methyl]phosphonic acid IUPAC Name: [phenyl-[4-[1-(3-propylphenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phosphonic acid Traditional Name: [phenyl-[4-[1-(3-propylphenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phosphonic acid Formula: C26H27N2O3P+2 MolecularWeight: 446.477941

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC=C1)[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C(C4=CC=CC=C4)P(=O)(O)O

Isomeric SMILES

CCCC1=CC(=CC=C1)[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)C(C4=CC=CC=C4)P(=O)(O)O

InChI

InChI=1S/C26H25N2O3P/c1-2-7-21-8-6-11-25(20-21)27-16-12-22(13-17-27)23-14-18-28(19-15-23)26(32(29,30)31)24-9-4-3-5-10-24/h3-6,8-20,26H,2,7H2,1H3/p+2