4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid

Systemtic Name: 4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid Openeye Name: 4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid CAS Name: 4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid IUPAC Name: 4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid Traditional Name: 4-[6-[2-(4-carboxyphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazol-2-yl]benzoic acid Formula: C28H18N4O4 MolecularWeight: 474.46692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)O)C(=O)O

InChI

InChI=1S/C28H18N4O4/c33-27(34)17-5-1-15(2-6-17)25-29-21-11-9-19(13-23(21)31-25)20-10-12-22-24(14-20)32-26(30-22)16-3-7-18(8-4-16)28(35)36/h1-14H,(H,29,31)(H,30,32)(H,33,34)(H,35,36)