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

Systemtic Name: 4-azanyl-N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-amino-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide CAS Name: 4-amino-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-amino-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide Traditional Name: 4-amino-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrole-2-carboxamide Formula: C12H9F2N3O3 MolecularWeight: 281.214966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9F2N3O3/c13-12(14)19-9-2-1-7(4-10(9)20-12)17-11(18)8-3-6(15)5-16-8/h1-5,16H,15H2,(H,17,18)