bis[(1-methyl-3-oxidanyl-pyridin-1-ium-4-yl)methyl]phosphinic acid

Systemtic Name: bis[(1-methyl-3-oxidanyl-pyridin-1-ium-4-yl)methyl]phosphinic acid Openeye Name: bis[(3-hydroxy-1-methyl-pyridin-1-ium-4-yl)methyl]phosphinic acid CAS Name: bis[(3-hydroxy-1-methyl-4-pyridin-1-iumyl)methyl]phosphinic acid IUPAC Name: bis[(3-hydroxy-1-methylpyridin-1-ium-4-yl)methyl]phosphinic acid Traditional Name: bis[(3-hydroxy-1-methyl-pyridin-1-ium-4-yl)methyl]phosphinic acid Formula: C14H19N2O4P+2 MolecularWeight: 310.285421

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC(=C(C=C1)CP(=O)(CC2=C(C=[N+](C=C2)C)O)O)O

Isomeric SMILES

C[N+]1=CC(=C(C=C1)CP(=O)(CC2=C(C=[N+](C=C2)C)O)O)O

InChI

InChI=1S/C14H17N2O4P/c1-15-5-3-11(13(17)7-15)9-21(19,20)10-12-4-6-16(2)8-14(12)18/h3-8H,9-10H2,1-2H3,(H-2,17,18,19,20)/p+2