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

Systemtic Name: [5-(hydroxymethyl)-2-methyl-pyridin-3-yl] 4-methylbenzoate Openeye Name: [5-(hydroxymethyl)-2-methyl-3-pyridyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-(hydroxymethyl)-2-methyl-3-pyridinyl] ester IUPAC Name: [5-(hydroxymethyl)-2-methylpyridin-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-methyl-5-methylol-3-pyridyl) ester Formula: C15H15NO3 MolecularWeight: 257.2845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(N=CC(=C2)CO)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(N=CC(=C2)CO)C

InChI

InChI=1S/C15H15NO3/c1-10-3-5-13(6-4-10)15(18)19-14-7-12(9-17)8-16-11(14)2/h3-8,17H,9H2,1-2H3