N-(2-azanylethyl)-3-[(4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(2-azanylethyl)-3-[(4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(2-aminoethyl)-3-[(4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: N-(2-aminoethyl)-3-[(4-nitro-1-pyrazolyl)methyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(2-aminoethyl)-3-[(4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(2-aminoethyl)-3-[(4-nitropyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Formula: C9H11N7O4 MolecularWeight: 281.22814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC2=NOC(=N2)C(=O)NCCN)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=NN1CC2=NOC(=N2)C(=O)NCCN)[N+](=O)[O-]

InChI

InChI=1S/C9H11N7O4/c10-1-2-11-8(17)9-13-7(14-20-9)5-15-4-6(3-12-15)16(18)19/h3-4H,1-2,5,10H2,(H,11,17)