N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-bromanyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-4-bromanyl-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide Formula: C12H7BrF2N2O3 MolecularWeight: 345.096386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C3=CC(=CN3)Br)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C3=CC(=CN3)Br)OC(O2)(F)F

InChI

InChI=1S/C12H7BrF2N2O3/c13-6-3-8(16-5-6)11(18)17-7-1-2-9-10(4-7)20-12(14,15)19-9/h1-5,16H,(H,17,18)