2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone

Systemtic Name: 2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone Openeye Name: 2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(p-tolyl)ethanone CAS Name: 2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone IUPAC Name: 2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(4-methylphenyl)ethanone Traditional Name: 2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-(p-tolyl)ethanone Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C(=NC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C12H12N4O3/c1-8-3-5-10(6-4-8)11(17)7-15-9(2)13-12(14-15)16(18)19/h3-6H,7H2,1-2H3