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

Systemtic Name: N-(3-bromanyl-4-methoxy-phenyl)-3,5-dinitro-benzamide Openeye Name: N-(3-bromo-4-methoxy-phenyl)-3,5-dinitro-benzamide CAS Name: N-(3-bromo-4-methoxyphenyl)-3,5-dinitrobenzamide IUPAC Name: N-(3-bromo-4-methoxyphenyl)-3,5-dinitrobenzamide Traditional Name: N-(3-bromo-4-methoxy-phenyl)-3,5-dinitro-benzamide Formula: C14H10BrN3O6 MolecularWeight: 396.1497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C14H10BrN3O6/c1-24-13-3-2-9(6-12(13)15)16-14(19)8-4-10(17(20)21)7-11(5-8)18(22)23/h2-7H,1H3,(H,16,19)