4-(2-bromanyl-5-fluoranyl-phenyl)carbonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2-bromanyl-5-fluoranyl-phenyl)carbonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(2-bromo-5-fluoro-benzoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(2-bromo-5-fluorophenyl)-oxomethyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(2-bromo-5-fluorobenzoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(2-bromo-5-fluoro-benzoyl)-1H-pyrrole-2-carboxylic acid Formula: C12H7BrFNO3 MolecularWeight: 312.091283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(=O)C2=CNC(=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=C(C=C1F)C(=O)C2=CNC(=C2)C(=O)O)Br

InChI

InChI=1S/C12H7BrFNO3/c13-9-2-1-7(14)4-8(9)11(16)6-3-10(12(17)18)15-5-6/h1-5,15H,(H,17,18)