1,4-dimethylbenzotriazole; N-(4-nitrophenyl)-1,2,4-triazol-4-amine

Systemtic Name: 1,4-dimethylbenzotriazole; N-(4-nitrophenyl)-1,2,4-triazol-4-amine Openeye Name: 1,4-dimethylbenzotriazole; N-(4-nitrophenyl)-1,2,4-triazol-4-amine CAS Name: 1,4-dimethylbenzotriazole; N-(4-nitrophenyl)-1,2,4-triazol-4-amine IUPAC Name: 1,4-dimethylbenzotriazole; N-(4-nitrophenyl)-1,2,4-triazol-4-amine Traditional Name: 1,4-dimethylbenzotriazole; (4-nitrophenyl)-(1,2,4-triazol-4-yl)amine Formula: C16H16N8O2 MolecularWeight: 352.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(N=N2)C.C1=CC(=CC=C1NN2C=NN=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)N(N=N2)C.C1=CC(=CC=C1NN2C=NN=C2)[N+](=O)[O-]

InChI

InChI=1S/C8H7N5O2.C8H9N3/c14-13(15)8-3-1-7(2-4-8)11-12-5-9-10-6-12;1-6-4-3-5-7-8(6)9-10-11(7)2/h1-6,11H;3-5H,1-2H3