2-(1-methylpyridin-1-ium-3-yl)ethylphosphanylmethylphosphonic acid

Systemtic Name: 2-(1-methylpyridin-1-ium-3-yl)ethylphosphanylmethylphosphonic acid Openeye Name: 2-(1-methylpyridin-1-ium-3-yl)ethylphosphanylmethylphosphonic acid CAS Name: 2-(1-methyl-3-pyridin-1-iumyl)ethylphosphinomethylphosphonic acid IUPAC Name: 2-(1-methylpyridin-1-ium-3-yl)ethylphosphanylmethylphosphonic acid Traditional Name: 2-(1-methylpyridin-1-ium-3-yl)ethylphosphinomethylphosphonic acid Formula: C9H16NO3P2+ MolecularWeight: 248.175762

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)CCPCP(=O)(O)O

Isomeric SMILES

C[N+]1=CC=CC(=C1)CCPCP(=O)(O)O

InChI

InChI=1S/C9H15NO3P2/c1-10-5-2-3-9(7-10)4-6-14-8-15(11,12)13/h2-3,5,7,14H,4,6,8H2,1H3,(H-,11,12,13)/p+1