5-[bis(2-bromoethyl)amino]-2,4-dinitro-N-oxidanyl-benzamide

Systemtic Name: 5-[bis(2-bromoethyl)amino]-2,4-dinitro-N-oxidanyl-benzamide Openeye Name: 5-[bis(2-bromoethyl)amino]-2,4-dinitro-benzenecarbohydroxamic acid CAS Name: 5-[bis(2-bromoethyl)amino]-N-hydroxy-2,4-dinitrobenzamide IUPAC Name: 5-[bis(2-bromoethyl)amino]-N-hydroxy-2,4-dinitrobenzamide Traditional Name: 5-[bis(2-bromoethyl)amino]-2,4-dinitro-benzenecarbohydroxamic acid Formula: C11H12Br2N4O6 MolecularWeight: 456.04418

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N(CCBr)CCBr)[N+](=O)[O-])[N+](=O)[O-])C(=O)NO

Isomeric SMILES

C1=C(C(=CC(=C1N(CCBr)CCBr)[N+](=O)[O-])[N+](=O)[O-])C(=O)NO

InChI

InChI=1S/C11H12Br2N4O6/c12-1-3-15(4-2-13)9-5-7(11(18)14-19)8(16(20)21)6-10(9)17(22)23/h5-6,19H,1-4H2,(H,14,18)