[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 5-methylpyrazine-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C16H16N2O3/c1-10-4-6-13(7-5-10)15(19)12(3)21-16(20)14-9-17-11(2)8-18-14/h4-9,12H,1-3H3