4-[2-(4-bromophenyl)ethanoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[2-(4-bromophenyl)ethanoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[2-(4-bromophenyl)acetyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2-(4-bromophenyl)-1-oxoethyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[2-(4-bromophenyl)acetyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[2-(4-bromophenyl)acetyl]-1H-pyrrole-2-carboxylic acid Formula: C13H10BrNO3 MolecularWeight: 308.1274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)C2=CNC(=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1CC(=O)C2=CNC(=C2)C(=O)O)Br

InChI

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