3-(4,6-dimethylpyridin-2-yl)pentan-3-ylphosphonic acid

Systemtic Name: 3-(4,6-dimethylpyridin-2-yl)pentan-3-ylphosphonic acid Openeye Name: [1-(4,6-dimethyl-2-pyridyl)-1-ethyl-propyl]phosphonic acid CAS Name: 3-(4,6-dimethyl-2-pyridinyl)pentan-3-ylphosphonic acid IUPAC Name: 3-(4,6-dimethylpyridin-2-yl)pentan-3-ylphosphonic acid Traditional Name: [1-(4,6-dimethyl-2-pyridyl)-1-ethyl-propyl]phosphonic acid Formula: C12H20NO3P MolecularWeight: 257.265861

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=CC(=N1)C)C)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=CC(=CC(=N1)C)C)P(=O)(O)O

InChI

InChI=1S/C12H20NO3P/c1-5-12(6-2,17(14,15)16)11-8-9(3)7-10(4)13-11/h7-8H,5-6H2,1-4H3,(H2,14,15,16)