N-(2H-benzotriazol-4-yl)-2,4,6-trinitro-benzamide

Systemtic Name: N-(2H-benzotriazol-4-yl)-2,4,6-trinitro-benzamide Openeye Name: N-(2H-benzotriazol-4-yl)-2,4,6-trinitro-benzamide CAS Name: N-(2H-benzotriazol-4-yl)-2,4,6-trinitrobenzamide IUPAC Name: N-(2H-benzotriazol-4-yl)-2,4,6-trinitrobenzamide Traditional Name: N-(2H-benzotriazol-4-yl)-2,4,6-trinitro-benzamide Formula: C13H7N7O7 MolecularWeight: 373.23738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C(=C1)NC(=O)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NNN=C2C(=C1)NC(=O)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H7N7O7/c21-13(14-7-2-1-3-8-12(7)16-17-15-8)11-9(19(24)25)4-6(18(22)23)5-10(11)20(26)27/h1-5H,(H,14,21)(H,15,16,17)