[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 6-chloranylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 6-chloranylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid (2-keto-2-mesityl-ethyl) ester Formula: C17H16ClNO3 MolecularWeight: 317.76684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)COC(=O)C2=CN=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)COC(=O)C2=CN=C(C=C2)Cl)C

InChI

InChI=1S/C17H16ClNO3/c1-10-6-11(2)16(12(3)7-10)14(20)9-22-17(21)13-4-5-15(18)19-8-13/h4-8H,9H2,1-3H3