[[(2-oxidanylpyridin-1-ium-4-yl)amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[(2-oxidanylpyridin-1-ium-4-yl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [[(2-hydroxypyridin-1-ium-4-yl)amino]-phosphono-methyl]phosphonic acid CAS Name: [[(2-hydroxy-4-pyridin-1-iumyl)amino]-phosphonomethyl]phosphonic acid IUPAC Name: [[(2-hydroxypyridin-1-ium-4-yl)amino]-phosphonomethyl]phosphonic acid Traditional Name: [[(2-hydroxypyridin-1-ium-4-yl)amino]-phosphono-methyl]phosphonic acid Formula: C6H11N2O7P2+ MolecularWeight: 285.108262

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH+]=C(C=C1NC(P(=O)(O)O)P(=O)(O)O)O

Isomeric SMILES

C1=C[NH+]=C(C=C1NC(P(=O)(O)O)P(=O)(O)O)O

InChI

InChI=1S/C6H10N2O7P2/c9-5-3-4(1-2-7-5)8-6(16(10,11)12)17(13,14)15/h1-3,6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)/p+1