Products 1246833-64-6

CAS 1246833-64-6 appears in our catalog under these names: Nifursol-15N2-d2, Nifursol-15N2,d2, >95% (HPLC), Nifursol-15N2,d2. Offered by: Chemat Brand, TRC, Biosynth, MedChemExpress. Available pack sizes: on request, 10mg, 1mg, 25mg, 50mg, 100mg, 1 mg.

Structural formula: {0} (CAS {1})

N-[(E)-(3,4-dideuterio-5-nitrofuran-2-yl)methylideneamino]-2-hydroxy-3,5-dinitro(15N2)benzamide (CAS 1246833-64-6) is a chemical compound with the molecular formula C12H7N5O9 and a molecular weight of 369.21 g/mol. IUPAC name: N-[(E)-(3,4-dideuterio-5-nitrofuran-2-yl)methylideneamino]-2-hydroxy-3,5-dinitro(15N2)benzamide. InChIKey: XXUXXCZCUGIGPP-QGMBFAGFSA-N.

Identity
Molecular formulaC12H7N5O9
Molecular weight369.21 g/mol
IUPAC nameN-[(E)-(3,4-dideuterio-5-nitrofuran-2-yl)methylideneamino]-2-hydroxy-3,5-dinitro(15N2)benzamide
InChIKeyXXUXXCZCUGIGPP-QGMBFAGFSA-N
SMILES[2H]C1=C(OC(=C1[2H])[N+](=O)[O-])/C=[15N]/[15NH]C(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O

Computed by PubChem (NCBI)