[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C12H14BrN3O4 MolecularWeight: 344.16126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=CN=C1)Br

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=CN=C1)Br

InChI

InChI=1S/C12H14BrN3O4/c1-7(2)15-12(19)16-10(17)6-20-11(18)8-3-9(13)5-14-4-8/h3-5,7H,6H2,1-2H3,(H2,15,16,17,19)