4-[(4-methylphenyl)methyl]-3-nitro-1,2,4-triazole

Systemtic Name: 4-[(4-methylphenyl)methyl]-3-nitro-1,2,4-triazole Openeye Name: 3-nitro-4-(p-tolylmethyl)-1,2,4-triazole CAS Name: 4-[(4-methylphenyl)methyl]-3-nitro-1,2,4-triazole IUPAC Name: 4-[(4-methylphenyl)methyl]-3-nitro-1,2,4-triazole Traditional Name: 4-(4-methylbenzyl)-3-nitro-1,2,4-triazole Formula: C10H10N4O2 MolecularWeight: 218.212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NN=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NN=C2[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O2/c1-8-2-4-9(5-3-8)6-13-7-11-12-10(13)14(15)16/h2-5,7H,6H2,1H3