[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H12BrN3O5 MolecularWeight: 382.16618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)NC(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=COC(=C1)CNC(=O)NC(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C14H12BrN3O5/c15-10-4-9(5-16-6-10)13(20)23-8-12(19)18-14(21)17-7-11-2-1-3-22-11/h1-6H,7-8H2,(H2,17,18,19,21)