N-(4-azanyl-3-nitro-phenyl)-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-(4-azanyl-3-nitro-phenyl)-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-(4-amino-3-nitro-phenyl)-1H-1,2,4-triazole-5-carboxamide CAS Name: N-(4-amino-3-nitrophenyl)-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-(4-amino-3-nitrophenyl)-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-(4-amino-3-nitro-phenyl)-1H-1,2,4-triazole-5-carboxamide Formula: C9H8N6O3 MolecularWeight: 248.19822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=NC=NN2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=NC=NN2)[N+](=O)[O-])N

InChI

InChI=1S/C9H8N6O3/c10-6-2-1-5(3-7(6)15(17)18)13-9(16)8-11-4-12-14-8/h1-4H,10H2,(H,13,16)(H,11,12,14)