[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C12H11BrN2O4 MolecularWeight: 327.13074

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1=COC(=C1)CNC(=O)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C12H11BrN2O4/c13-8-4-10(14-5-8)12(17)19-7-11(16)15-6-9-2-1-3-18-9/h1-5,14H,6-7H2,(H,15,16)