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

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C13H9BrClNO3 MolecularWeight: 342.57246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=CN2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)C2=CC(=CN2)Br)Cl

InChI

InChI=1S/C13H9BrClNO3/c14-9-5-11(16-6-9)13(18)19-7-12(17)8-1-3-10(15)4-2-8/h1-6,16H,7H2