3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole

Systemtic Name: 3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole Openeye Name: 3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole CAS Name: 3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole Traditional Name: 3-(3,5-dinitrophenyl)-5-methyl-1H-1,2,4-triazole Formula: C9H7N5O4 MolecularWeight: 249.18298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NN1)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N5O4/c1-5-10-9(12-11-5)6-2-7(13(15)16)4-8(3-6)14(17)18/h2-4H,1H3,(H,10,11,12)