2-[6-(imidazol-1-ylmethyl)-1H-benzimidazol-2-yl]benzoic acid

Systemtic Name: 2-[6-(imidazol-1-ylmethyl)-1H-benzimidazol-2-yl]benzoic acid Openeye Name: 2-[6-(imidazol-1-ylmethyl)-1H-benzimidazol-2-yl]benzoic acid CAS Name: 2-[6-(1-imidazolylmethyl)-1H-benzimidazol-2-yl]benzoic acid IUPAC Name: 2-[6-(imidazol-1-ylmethyl)-1H-benzimidazol-2-yl]benzoic acid Traditional Name: 2-[6-(imidazol-1-ylmethyl)-1H-benzimidazol-2-yl]benzoic acid Formula: C18H14N4O2 MolecularWeight: 318.32936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)CN4C=CN=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)CN4C=CN=C4)C(=O)O

InChI

InChI=1S/C18H14N4O2/c23-18(24)14-4-2-1-3-13(14)17-20-15-6-5-12(9-16(15)21-17)10-22-8-7-19-11-22/h1-9,11H,10H2,(H,20,21)(H,23,24)