1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-(6-nitro-4H-1,3-benzodioxin-8-yl)methylene-(1,2,4-triazol-4-yl)amine Formula: C11H9N5O4 MolecularWeight: 275.22026

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=NN3C=NN=C3)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=N/N3C=NN=C3)OCO1

InChI

InChI=1S/C11H9N5O4/c17-16(18)10-1-8(3-14-15-5-12-13-6-15)11-9(2-10)4-19-7-20-11/h1-3,5-6H,4,7H2/b14-3+