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

Systemtic Name: 3,5-dinitro-N-(3H-1,2,4-triazol-3-yl)benzamide Openeye Name: 3,5-dinitro-N-(3H-1,2,4-triazol-3-yl)benzamide CAS Name: 3,5-dinitro-N-(3H-1,2,4-triazol-3-yl)benzamide IUPAC Name: 3,5-dinitro-N-(3H-1,2,4-triazol-3-yl)benzamide Traditional Name: 3,5-dinitro-N-(3H-1,2,4-triazol-3-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)NC2N=CN=N2

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NC2N=CN=N2

InChI

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