3-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzoic acid

Systemtic Name: 3-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzoic acid Openeye Name: 3-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]benzoic acid CAS Name: 3-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridinyl)-1H-imidazol-2-yl]benzoic acid IUPAC Name: 3-[4-(1,3-benzodioxol-5-yl)-5-pyridin-2-yl-1H-imidazol-2-yl]benzoic acid Traditional Name: 3-[4-(1,3-benzodioxol-5-yl)-5-(2-pyridyl)-1H-imidazol-2-yl]benzoic acid Formula: C22H15N3O4 MolecularWeight: 385.3722

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(NC(=N3)C4=CC(=CC=C4)C(=O)O)C5=CC=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(NC(=N3)C4=CC(=CC=C4)C(=O)O)C5=CC=CC=N5

InChI

InChI=1S/C22H15N3O4/c26-22(27)15-5-3-4-14(10-15)21-24-19(20(25-21)16-6-1-2-9-23-16)13-7-8-17-18(11-13)29-12-28-17/h1-11H,12H2,(H,24,25)(H,26,27)