4-[3,3,3-tris(fluoranyl)propanoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[3,3,3-tris(fluoranyl)propanoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3,3,3-trifluoropropanoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(3,3,3-trifluoro-1-oxopropyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3,3,3-trifluoropropanoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(3,3,3-trifluoropropanoyl)-1H-pyrrole-2-carboxylic acid Formula: C8H6F3NO3 MolecularWeight: 221.13335

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=C1C(=O)CC(F)(F)F)C(=O)O

Isomeric SMILES

C1=C(NC=C1C(=O)CC(F)(F)F)C(=O)O

InChI

InChI=1S/C8H6F3NO3/c9-8(10,11)2-6(13)4-1-5(7(14)15)12-3-4/h1,3,12H,2H2,(H,14,15)