[2-(4-dibenzofuran-4-ylpyridin-1-ium-1-yl)-1-oxidanyl-1-phosphono-ethyl]-oxidanyl-phosphinate

Systemtic Name: [2-(4-dibenzofuran-4-ylpyridin-1-ium-1-yl)-1-oxidanyl-1-phosphono-ethyl]-oxidanyl-phosphinate Openeye Name: [2-(4-dibenzofuran-4-ylpyridin-1-ium-1-yl)-1-hydroxy-1-phosphono-ethyl]-hydroxy-phosphinate CAS Name: [2-[4-(4-dibenzofuranyl)-1-pyridin-1-iumyl]-1-hydroxy-1-phosphonoethyl]-hydroxyphosphinate IUPAC Name: [2-(4-dibenzofuran-4-ylpyridin-1-ium-1-yl)-1-hydroxy-1-phosphonoethyl]-hydroxyphosphinate Traditional Name: [2-(4-dibenzofuran-4-ylpyridin-1-ium-1-yl)-1-hydroxy-1-phosphono-ethyl]-hydroxy-phosphinate Formula: C19H17NO8P2 MolecularWeight: 449.287702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=[N+](C=C4)CC(O)(P(=O)(O)O)P(=O)(O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC=[N+](C=C4)CC(O)(P(=O)(O)O)P(=O)(O)[O-]

InChI

InChI=1S/C19H17NO8P2/c21-19(29(22,23)24,30(25,26)27)12-20-10-8-13(9-11-20)14-5-3-6-16-15-4-1-2-7-17(15)28-18(14)16/h1-11,21H,12H2,(H3-,22,23,24,25,26,27)