4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid

Systemtic Name: 4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid Openeye Name: 4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid CAS Name: 4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid IUPAC Name: 4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid Traditional Name: 4,7-bis[2-(2-hydroxyethylsulfamoyl)phenyl]-1,10-phenanthroline-2,9-dicarboxylic acid Formula: C30H26N4O10S2 MolecularWeight: 666.67824

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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)NCCO)C(=O)O)C(=O)O)S(=O)(=O)NCCO

Isomeric SMILES

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

InChI

InChI=1S/C30H26N4O10S2/c35-13-11-31-45(41,42)25-7-3-1-5-17(25)21-15-23(29(37)38)33-27-19(21)9-10-20-22(16-24(30(39)40)34-28(20)27)18-6-2-4-8-26(18)46(43,44)32-12-14-36/h1-10,15-16,31-32,35-36H,11-14H2,(H,37,38)(H,39,40)