[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(benzylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H14BrN3O4 MolecularWeight: 392.20406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O4/c17-13-6-12(8-18-9-13)15(22)24-10-14(21)20-16(23)19-7-11-4-2-1-3-5-11/h1-6,8-9H,7,10H2,(H2,19,20,21,23)