2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid

Systemtic Name: 2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid Openeye Name: 2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid CAS Name: 2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid IUPAC Name: 2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid Traditional Name: 2-[4-(5,6-dimethyl-1H-benzimidazol-2-yl)phenyl]-1H-benzimidazole-5,6-disulfonic acid Formula: C22H18N4O6S2 MolecularWeight: 498.53152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C3=CC=C(C=C3)C4=NC5=CC(=C(C=C5N4)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CC=C(C=C3)C4=NC5=CC(=C(C=C5N4)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C22H18N4O6S2/c1-11-7-15-16(8-12(11)2)24-21(23-15)13-3-5-14(6-4-13)22-25-17-9-19(33(27,28)29)20(34(30,31)32)10-18(17)26-22/h3-10H,1-2H3,(H,23,24)(H,25,26)(H,27,28,29)(H,30,31,32)