3-nitro-1-(4-nitrophenyl)-1,2,4-triazole

Systemtic Name: 3-nitro-1-(4-nitrophenyl)-1,2,4-triazole Openeye Name: 3-nitro-1-(4-nitrophenyl)-1,2,4-triazole CAS Name: 3-nitro-1-(4-nitrophenyl)-1,2,4-triazole IUPAC Name: 3-nitro-1-(4-nitrophenyl)-1,2,4-triazole Traditional Name: 3-nitro-1-(4-nitrophenyl)-1,2,4-triazole Formula: C8H5N5O4 MolecularWeight: 235.1564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H5N5O4/c14-12(15)7-3-1-6(2-4-7)11-5-9-8(10-11)13(16)17/h1-5H