[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: [(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: [(1S)-2-morpholino-2-oxo-1-phenyl-ethyl] 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid [(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid [(1S)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N3CCOCC3)Cl)C

InChI

InChI=1S/C20H21ClN2O4/c1-13-12-14(2)22-18(21)16(13)20(25)27-17(15-6-4-3-5-7-15)19(24)23-8-10-26-11-9-23/h3-7,12,17H,8-11H2,1-2H3/t17-/m0/s1