[[4-[1-(2,4-dinitrophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-phenyl-methyl]phosphonic acid

Systemtic Name: [[4-[1-(2,4-dinitrophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-phenyl-methyl]phosphonic acid Openeye Name: [[4-[1-(2,4-dinitrophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-phenyl-methyl]phosphonic acid CAS Name: [[4-[1-(2,4-dinitrophenyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]-phenylmethyl]phosphonic acid IUPAC Name: [[4-[1-(2,4-dinitrophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-phenylmethyl]phosphonic acid Traditional Name: [[4-[1-(2,4-dinitrophenyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-phenyl-methyl]phosphonic acid Formula: C23H19N4O7P+2 MolecularWeight: 494.393321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17N4O7P/c28-26(29)20-6-7-21(22(16-20)27(30)31)24-12-8-17(9-13-24)18-10-14-25(15-11-18)23(35(32,33)34)19-4-2-1-3-5-19/h1-16,23H/p+2