[2-(3,5-dimethylpyrazol-1-yl)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(3,5-dimethylpyrazol-1-yl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(3,5-dimethylpyrazol-1-yl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(3,5-dimethyl-1-pyrazolyl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(3,5-dimethylpyrazol-1-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(3,5-dimethylpyrazol-1-yl)-1-phosphono-ethyl]phosphonic acid Formula: C7H14N2O6P2 MolecularWeight: 284.143382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(P(=O)(O)O)P(=O)(O)O)C

Isomeric SMILES

CC1=CC(=NN1CC(P(=O)(O)O)P(=O)(O)O)C

InChI

InChI=1S/C7H14N2O6P2/c1-5-3-6(2)9(8-5)4-7(16(10,11)12)17(13,14)15/h3,7H,4H2,1-2H3,(H2,10,11,12)(H2,13,14,15)