N-(2-methyl-1,2,3,4-tetrazol-5-yl)-3-nitro-benzamide

Systemtic Name: N-(2-methyl-1,2,3,4-tetrazol-5-yl)-3-nitro-benzamide Openeye Name: N-(2-methyltetrazol-5-yl)-3-nitro-benzamide CAS Name: N-(2-methyl-5-tetrazolyl)-3-nitrobenzamide IUPAC Name: N-(2-methyltetrazol-5-yl)-3-nitrobenzamide Traditional Name: N-(2-methyltetrazol-5-yl)-3-nitro-benzamide Formula: C9H8N6O3 MolecularWeight: 248.19822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1N=C(N=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C9H8N6O3/c1-14-12-9(11-13-14)10-8(16)6-3-2-4-7(5-6)15(17)18/h2-5H,1H3,(H,10,12,16)