[2-(3,5-dimethylphenyl)-3-oxidanyl-1,5-dihydropyrazol-4-yl]phosphonic acid

Systemtic Name: [2-(3,5-dimethylphenyl)-3-oxidanyl-1,5-dihydropyrazol-4-yl]phosphonic acid Openeye Name: [2-(3,5-dimethylphenyl)-3-hydroxy-1,5-dihydropyrazol-4-yl]phosphonic acid CAS Name: [2-(3,5-dimethylphenyl)-3-hydroxy-1,5-dihydropyrazol-4-yl]phosphonic acid IUPAC Name: [2-(3,5-dimethylphenyl)-3-hydroxy-1,5-dihydropyrazol-4-yl]phosphonic acid Traditional Name: [1-(3,5-dimethylphenyl)-5-hydroxy-3-pyrazolin-4-yl]phosphonic acid Formula: C11H15N2O4P MolecularWeight: 270.221561

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(CN2)P(=O)(O)O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C(CN2)P(=O)(O)O)O)C

InChI

InChI=1S/C11H15N2O4P/c1-7-3-8(2)5-9(4-7)13-11(14)10(6-12-13)18(15,16)17/h3-5,12,14H,6H2,1-2H3,(H2,15,16,17)