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

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C13H9F2N3O5 MolecularWeight: 325.224466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H9F2N3O5/c1-17-6-8(18(20)21)5-9(17)12(19)16-7-2-3-10-11(4-7)23-13(14,15)22-10/h2-6H,1H3,(H,16,19)