4-[6-(1-imidazol-1-ylethyl)-1H-benzimidazol-2-yl]benzoic acid

Systemtic Name: 4-[6-(1-imidazol-1-ylethyl)-1H-benzimidazol-2-yl]benzoic acid Openeye Name: 4-[6-(1-imidazol-1-ylethyl)-1H-benzimidazol-2-yl]benzoic acid CAS Name: 4-[6-[1-(1-imidazolyl)ethyl]-1H-benzimidazol-2-yl]benzoic acid IUPAC Name: 4-[6-(1-imidazol-1-ylethyl)-1H-benzimidazol-2-yl]benzoic acid Traditional Name: 4-[6-(1-imidazol-1-ylethyl)-1H-benzimidazol-2-yl]benzoic acid Formula: C19H16N4O2 MolecularWeight: 332.35594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)C(=O)O)N4C=CN=C4

Isomeric SMILES

CC(C1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)C(=O)O)N4C=CN=C4

InChI

InChI=1S/C19H16N4O2/c1-12(23-9-8-20-11-23)15-6-7-16-17(10-15)22-18(21-16)13-2-4-14(5-3-13)19(24)25/h2-12H,1H3,(H,21,22)(H,24,25)