3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propanoic acid Openeye Name: 3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(4-cyanophenyl)-2-(1H-imidazol-5-yl)propionic acid Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C2=CN=CN2)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CC(C2=CN=CN2)C(=O)O)C#N

InChI

InChI=1S/C13H11N3O2/c14-6-10-3-1-9(2-4-10)5-11(13(17)18)12-7-15-8-16-12/h1-4,7-8,11H,5H2,(H,15,16)(H,17,18)