5-[[4-cyano-5-[oxidanyl(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[[4-cyano-5-[oxidanyl(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid Openeye Name: 5-[[4-cyano-5-[hydroxy(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid CAS Name: 5-[[4-cyano-5-[hydroxy(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenylbenzoic acid IUPAC Name: 5-[[4-cyano-5-[hydroxy(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenylbenzoic acid Traditional Name: 5-[[4-cyano-5-[hydroxy(phenyl)methyl]-1H-imidazol-2-yl]methyl]-2-phenyl-benzoic acid Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC(=C(N3)C(C4=CC=CC=C4)O)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC(=C(N3)C(C4=CC=CC=C4)O)C#N)C(=O)O

InChI

InChI=1S/C25H19N3O3/c26-15-21-23(24(29)18-9-5-2-6-10-18)28-22(27-21)14-16-11-12-19(20(13-16)25(30)31)17-7-3-1-4-8-17/h1-13,24,29H,14H2,(H,27,28)(H,30,31)