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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(5-methyl-4-nitro-1H-pyrazol-3-yl)-1H-1,2,4-triazol-3-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(5-methyl-4-nitro-1H-pyrazol-3-yl)-1H-1,2,4-triazol-3-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(5-methyl-4-nitro-1H-pyrazol-3-yl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(5-methyl-4-nitro-1H-pyrazol-3-yl)-1H-1,2,4-triazol-3-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[5-(5-methyl-4-nitro-1H-pyrazol-3-yl)-1H-1,2,4-triazol-3-yl]amine Formula: C14H13N7O4 MolecularWeight: 343.29752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C2=NC(=NN2)NC3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C2=NC(=NN2)NC3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C14H13N7O4/c1-7-12(21(22)23)11(18-17-7)13-16-14(20-19-13)15-8-2-3-9-10(6-8)25-5-4-24-9/h2-3,6H,4-5H2,1H3,(H,17,18)(H2,15,16,19,20)