N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-yl]amine Formula: C13H11N7O4 MolecularWeight: 329.27094

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NNC(=N3)C4=C(C=NN4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NNC(=N3)C4=C(C=NN4)[N+](=O)[O-]

InChI

InChI=1S/C13H11N7O4/c21-20(22)8-6-14-17-11(8)12-16-13(19-18-12)15-7-1-2-9-10(5-7)24-4-3-23-9/h1-2,5-6H,3-4H2,(H,14,17)(H2,15,16,18,19)