2,3,5,6-tetradeuterio-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-4-oxidanyl-benzamide

Systemtic Name: 2,3,5,6-tetradeuterio-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-4-oxidanyl-benzamide Openeye Name: 2,3,5,6-tetradeuterio-4-hydroxy-N-[(E)-(5-nitro-2-furyl)methyleneamino]benzamide CAS Name: 2,3,5,6-tetradeuterio-4-hydroxy-N-[(E)-(5-nitro-2-furanyl)methylideneamino]benzamide IUPAC Name: 2,3,5,6-tetradeuterio-4-hydroxy-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide Traditional Name: 2,3,5,6-tetradeuterio-4-hydroxy-N-[(E)-(5-nitro-2-furyl)methyleneamino]benzamide Formula: C12H9N3O5 MolecularWeight: 279.241607

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NN=CC2=CC=C(O2)[N+](=O)[O-])O

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1C(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-])[2H])[2H])O)[2H]

InChI

InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)/b13-7+/i1D,2D,3D,4D