[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H17ClN2O3 MolecularWeight: 284.73868

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=C(N=C(C=C1C)C)Cl

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=C(N=C(C=C1C)C)Cl

InChI

InChI=1S/C13H17ClN2O3/c1-5-15-12(17)9(4)19-13(18)10-7(2)6-8(3)16-11(10)14/h6,9H,5H2,1-4H3,(H,15,17)/t9-/m0/s1