[4-ethyl-5-(hydroxymethyl)-2-methyl-pyridin-3-yl] dihydrogen phosphate

Systemtic Name: [4-ethyl-5-(hydroxymethyl)-2-methyl-pyridin-3-yl] dihydrogen phosphate Openeye Name: [4-ethyl-5-(hydroxymethyl)-2-methyl-3-pyridyl] dihydrogen phosphate CAS Name: [4-ethyl-5-(hydroxymethyl)-2-methyl-3-pyridinyl] dihydrogen phosphate IUPAC Name: [4-ethyl-5-(hydroxymethyl)-2-methylpyridin-3-yl] dihydrogen phosphate Traditional Name: (4-ethyl-2-methyl-5-methylol-3-pyridyl) dihydrogen phosphate Formula: C9H14NO5P MolecularWeight: 247.184921

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=C1CO)C)OP(=O)(O)O

Isomeric SMILES

CCC1=C(C(=NC=C1CO)C)OP(=O)(O)O

InChI

InChI=1S/C9H14NO5P/c1-3-8-7(5-11)4-10-6(2)9(8)15-16(12,13)14/h4,11H,3,5H2,1-2H3,(H2,12,13,14)