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

Systemtic Name: N-(4-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine Openeye Name: N-(4-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine CAS Name: N-(4-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(4-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-amine Traditional Name: (4-methoxyphenyl)-[5-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-3-yl]amine Formula: C12H11N7O3 MolecularWeight: 301.26084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NNC(=N2)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NNC(=N2)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C12H11N7O3/c1-22-8-4-2-7(3-5-8)14-12-15-11(17-18-12)10-9(19(20)21)6-13-16-10/h2-6H,1H3,(H,13,16)(H2,14,15,17,18)