[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 3,4,5-trichloropyridine-2-carboxylate CAS Name: 3,4,5-trichloro-2-pyridinecarboxylic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 3,4,5-trichloropyridine-2-carboxylate Traditional Name: 3,4,5-trichloropicolinic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C13H15Cl3N2O3 MolecularWeight: 353.6288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=NC=C(C(=C1Cl)Cl)Cl

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=NC=C(C(=C1Cl)Cl)Cl

InChI

InChI=1S/C13H15Cl3N2O3/c1-3-4-7(2)18-9(19)6-21-13(20)12-11(16)10(15)8(14)5-17-12/h5,7H,3-4,6H2,1-2H3,(H,18,19)/t7-/m0/s1