N-(2-bromanyl-4-nitro-phenyl)-3,5-dinitro-benzamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-3,5-dinitro-benzamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-3,5-dinitro-benzamide CAS Name: N-(2-bromo-4-nitrophenyl)-3,5-dinitrobenzamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-3,5-dinitrobenzamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-3,5-dinitro-benzamide Formula: C13H7BrN4O7 MolecularWeight: 411.12128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H7BrN4O7/c14-11-6-8(16(20)21)1-2-12(11)15-13(19)7-3-9(17(22)23)5-10(4-7)18(24)25/h1-6H,(H,15,19)