4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid

Systemtic Name: 4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid Openeye Name: 4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid CAS Name: 4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid IUPAC Name: 4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid Traditional Name: 4-(4,5-dicyano-1H-imidazol-2-yl)benzoic acid Formula: C12H6N4O2 MolecularWeight: 238.20164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=C(N2)C#N)C#N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=C(N2)C#N)C#N)C(=O)O

InChI

InChI=1S/C12H6N4O2/c13-5-9-10(6-14)16-11(15-9)7-1-3-8(4-2-7)12(17)18/h1-4H,(H,15,16)(H,17,18)