[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-chloranylpyridine-3-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C17H17ClN2O3 MolecularWeight: 332.78148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=C(N=CC=C1)Cl)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=C(N=CC=C1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H17ClN2O3/c1-12(13-6-3-2-4-7-13)10-20-15(21)11-23-17(22)14-8-5-9-19-16(14)18/h2-9,12H,10-11H2,1H3,(H,20,21)/t12-/m1/s1