[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C12H12BrN3O4 MolecularWeight: 342.14538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrN3O4/c1-2-3-15-12(19)16-10(17)7-20-11(18)8-4-9(13)6-14-5-8/h2,4-6H,1,3,7H2,(H2,15,16,17,19)