1-(4,6-dimethylpyridin-2-yl)oxy-3-phosphonato-propan-2-one

Systemtic Name: 1-(4,6-dimethylpyridin-2-yl)oxy-3-phosphonato-propan-2-one Openeye Name: 1-[(4,6-dimethyl-2-pyridyl)oxy]-3-phosphonato-propan-2-one CAS Name: 1-[(4,6-dimethyl-2-pyridinyl)oxy]-3-phosphonato-2-propanone IUPAC Name: 1-(4,6-dimethylpyridin-2-yl)oxy-3-phosphonatopropan-2-one Traditional Name: 1-[(4,6-dimethyl-2-pyridyl)oxy]-3-phosphonato-acetone Formula: C10H12NO5P-2 MolecularWeight: 257.179741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1)OCC(=O)CP(=O)([O-])[O-])C

Isomeric SMILES

CC1=CC(=NC(=C1)OCC(=O)CP(=O)([O-])[O-])C

InChI

InChI=1S/C10H14NO5P/c1-7-3-8(2)11-10(4-7)16-5-9(12)6-17(13,14)15/h3-4H,5-6H2,1-2H3,(H2,13,14,15)/p-2