N-(4-bromanyl-2-fluoranyl-phenyl)-2,4-dinitro-benzamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2,4-dinitro-benzamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2,4-dinitro-benzamide CAS Name: N-(4-bromo-2-fluorophenyl)-2,4-dinitrobenzamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2,4-dinitrobenzamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2,4-dinitro-benzamide Formula: C13H7BrFN3O5 MolecularWeight: 384.114183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H7BrFN3O5/c14-7-1-4-11(10(15)5-7)16-13(19)9-3-2-8(17(20)21)6-12(9)18(22)23/h1-6H,(H,16,19)