[5-(hydroxymethyl)-2-methyl-pyridin-3-yl] pyridine-4-carboxylate

Systemtic Name: [5-(hydroxymethyl)-2-methyl-pyridin-3-yl] pyridine-4-carboxylate Openeye Name: [5-(hydroxymethyl)-2-methyl-3-pyridyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [5-(hydroxymethyl)-2-methyl-3-pyridinyl] ester IUPAC Name: [5-(hydroxymethyl)-2-methylpyridin-3-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid (2-methyl-5-methylol-3-pyridyl) ester Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=N1)CO)OC(=O)C2=CC=NC=C2

Isomeric SMILES

CC1=C(C=C(C=N1)CO)OC(=O)C2=CC=NC=C2

InChI

InChI=1S/C13H12N2O3/c1-9-12(6-10(8-16)7-15-9)18-13(17)11-2-4-14-5-3-11/h2-7,16H,8H2,1H3