4,7-bis(2-chloranylsulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid

Systemtic Name: 4,7-bis(2-chloranylsulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid Openeye Name: 4,7-bis(2-chlorosulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid CAS Name: 4,7-bis(2-chlorosulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid IUPAC Name: 4,7-bis(2-chlorosulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid Traditional Name: 4,7-bis(2-chlorosulfonylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid Formula: C26H14Cl2N2O8S2 MolecularWeight: 617.43396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4C5=CC=CC=C5S(=O)(=O)Cl)C(=O)O)C(=O)O)S(=O)(=O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4C5=CC=CC=C5S(=O)(=O)Cl)C(=O)O)C(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C26H14Cl2N2O8S2/c27-39(35,36)21-7-3-1-5-13(21)17-11-19(25(31)32)29-23-15(17)9-10-16-18(12-20(26(33)34)30-24(16)23)14-6-2-4-8-22(14)40(28,37)38/h1-12H,(H,31,32)(H,33,34)