[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3,4,5-trichloropyridine-2-carboxylate CAS Name: 3,4,5-trichloro-2-pyridinecarboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3,4,5-trichloropyridine-2-carboxylate Traditional Name: 3,4,5-trichloropicolinic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H16Cl3N3O4 MolecularWeight: 396.65354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=NC=C(C(=C1Cl)Cl)Cl

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=NC=C(C(=C1Cl)Cl)Cl

InChI

InChI=1S/C14H16Cl3N3O4/c1-7(2)3-4-18-14(23)20-9(21)6-24-13(22)12-11(17)10(16)8(15)5-19-12/h5,7H,3-4,6H2,1-2H3,(H2,18,20,21,23)