[(1S)-1-(2-chlorophenyl)ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: [(1S)-1-(2-chlorophenyl)ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: [(1S)-1-(2-chlorophenyl)ethyl] 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid [(1S)-1-(2-chlorophenyl)ethyl] ester IUPAC Name: [(1S)-1-(2-chlorophenyl)ethyl] 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid [(1S)-1-(2-chlorophenyl)ethyl] ester Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OC(C)C2=CC=CC=C2Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)O[C@@H](C)C2=CC=CC=C2Cl)Cl)C

InChI

InChI=1S/C16H15Cl2NO2/c1-9-8-10(2)19-15(18)14(9)16(20)21-11(3)12-6-4-5-7-13(12)17/h4-8,11H,1-3H3/t11-/m0/s1