N-(1H-2,1,3-benzoxadiazol-3-ylmethyl)-N-(4-nitrophenyl)-1,2,4-triazol-1-amine

Systemtic Name: N-(1H-2,1,3-benzoxadiazol-3-ylmethyl)-N-(4-nitrophenyl)-1,2,4-triazol-1-amine Openeye Name: N-(1H-2,1,3-benzoxadiazol-3-ylmethyl)-N-(4-nitrophenyl)-1,2,4-triazol-1-amine CAS Name: N-(1H-2,1,3-benzoxadiazol-3-ylmethyl)-N-(4-nitrophenyl)-1,2,4-triazol-1-amine IUPAC Name: N-(1H-2,1,3-benzoxadiazol-3-ylmethyl)-N-(4-nitrophenyl)-1,2,4-triazol-1-amine Traditional Name: 3H-benzofurazan-1-ylmethyl-(4-nitrophenyl)-(1,2,4-triazol-1-yl)amine Formula: C15H13N7O3 MolecularWeight: 339.30882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NON2CN(C3=CC=C(C=C3)[N+](=O)[O-])N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)NON2CN(C3=CC=C(C=C3)[N+](=O)[O-])N4C=NC=N4

InChI

InChI=1S/C15H13N7O3/c23-22(24)13-7-5-12(6-8-13)19(21-10-16-9-17-21)11-20-15-4-2-1-3-14(15)18-25-20/h1-10,18H,11H2