4-bromanyl-5-nitro-benzene-1,3-dicarboxylic acid

Systemtic Name: 4-bromanyl-5-nitro-benzene-1,3-dicarboxylic acid Openeye Name: 4-bromo-5-nitro-benzene-1,3-dicarboxylic acid CAS Name: 4-bromo-5-nitrobenzene-1,3-dicarboxylic acid IUPAC Name: 4-bromo-5-nitrobenzene-1,3-dicarboxylic acid Traditional Name: 4-bromo-5-nitro-isophthalic acid Formula: C8H4BrNO6 MolecularWeight: 290.02446

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C(=O)O)Br)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1C(=O)O)Br)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H4BrNO6/c9-6-4(8(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,(H,11,12)(H,13,14)