3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide Openeye Name: 3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide CAS Name: 3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide Traditional Name: 3,5-dinitro-N-(1,2,4-triazol-4-yl)benzamide Formula: C9H6N6O5 MolecularWeight: 278.18114

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NN2C=NN=C2

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NN2C=NN=C2

InChI

InChI=1S/C9H6N6O5/c16-9(12-13-4-10-11-5-13)6-1-7(14(17)18)3-8(2-6)15(19)20/h1-5H,(H,12,16)