1-methyl-5-(4-nitrophenyl)benzotriazole; N-methyl-1,2,4-triazol-4-amine

Systemtic Name: 1-methyl-5-(4-nitrophenyl)benzotriazole; N-methyl-1,2,4-triazol-4-amine Openeye Name: 1-methyl-5-(4-nitrophenyl)benzotriazole; N-methyl-1,2,4-triazol-4-amine CAS Name: 1-methyl-5-(4-nitrophenyl)benzotriazole; N-methyl-1,2,4-triazol-4-amine IUPAC Name: 1-methyl-5-(4-nitrophenyl)benzotriazole; N-methyl-1,2,4-triazol-4-amine Traditional Name: 1-methyl-5-(4-nitrophenyl)benzotriazole; methyl(1,2,4-triazol-4-yl)amine Formula: C16H16N8O2 MolecularWeight: 352.35064

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Descriptors Computed from Structure

Canonical SMILES:

CNN1C=NN=C1.CN1C2=C(C=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])N=N1

Isomeric SMILES

CNN1C=NN=C1.CN1C2=C(C=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])N=N1

InChI

InChI=1S/C13H10N4O2.C3H6N4/c1-16-13-7-4-10(8-12(13)14-15-16)9-2-5-11(6-3-9)17(18)19;1-4-7-2-5-6-3-7/h2-8H,1H3;2-4H,1H3