[2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C15H14BrN3O4 MolecularWeight: 380.19336

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CNC(=O)NC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C15H14BrN3O4/c1-17-15(22)19-13(20)12(9-5-3-2-4-6-9)23-14(21)11-7-10(16)8-18-11/h2-8,12,18H,1H3,(H2,17,19,20,22)