[2-(3-bromophenyl)-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 1H-pyrrole-2-carboxylate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C13H10BrNO3 MolecularWeight: 308.1274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrNO3/c14-10-4-1-3-9(7-10)12(16)8-18-13(17)11-5-2-6-15-11/h1-7,15H,8H2