[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl pyridine-3-carboxylate

Systemtic Name: [4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methyl pyridine-3-carboxylate Openeye Name: [5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyl ester IUPAC Name: [5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl pyridine-3-carboxylate Traditional Name: nicotinic acid (5-hydroxy-6-methyl-4-methylol-3-pyridyl)methyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CO)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=NC=C(C(=C1O)CO)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H14N2O4/c1-9-13(18)12(7-17)11(6-16-9)8-20-14(19)10-3-2-4-15-5-10/h2-6,17-18H,7-8H2,1H3