[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-chloro-1H-pyrrole-2-carboxylate CAS Name: 4-chloro-1H-pyrrole-2-carboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-chloro-1H-pyrrole-2-carboxylate Traditional Name: 4-chloro-1H-pyrrole-2-carboxylic acid [2-(4-bromophenyl)-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)Cl)Br

Isomeric SMILES

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

InChI

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