2-iodyl-4,5-dinitro-benzene-1,3-dicarboxylic acid

Systemtic Name: 2-iodyl-4,5-dinitro-benzene-1,3-dicarboxylic acid Openeye Name: 2-iodyl-4,5-dinitro-benzene-1,3-dicarboxylic acid CAS Name: 2-iodyl-4,5-dinitrobenzene-1,3-dicarboxylic acid IUPAC Name: 2-iodyl-4,5-dinitrobenzene-1,3-dicarboxylic acid Traditional Name: 2-iodyl-4,5-dinitro-isophthalic acid Formula: C8H3IN2O10 MolecularWeight: 414.02129

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O)I(=O)=O)C(=O)O

Isomeric SMILES

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O)I(=O)=O)C(=O)O

InChI

InChI=1S/C8H3IN2O10/c12-7(13)2-1-3(10(18)19)6(11(20)21)4(8(14)15)5(2)9(16)17/h1H,(H,12,13)(H,14,15)