3-(imidazol-1-ylmethyl)-3-phenyl-1H-2-benzofuran-5-carboxylic acid

Systemtic Name: 3-(imidazol-1-ylmethyl)-3-phenyl-1H-2-benzofuran-5-carboxylic acid Openeye Name: 3-(imidazol-1-ylmethyl)-3-phenyl-1H-isobenzofuran-5-carboxylic acid CAS Name: 3-(1-imidazolylmethyl)-3-phenyl-1H-isobenzofuran-5-carboxylic acid IUPAC Name: 3-(imidazol-1-ylmethyl)-3-phenyl-1H-2-benzofuran-5-carboxylic acid Traditional Name: 3-(imidazol-1-ylmethyl)-3-phenyl-phthalan-5-carboxylic acid Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)O)C(O1)(CN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)O)C(O1)(CN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N2O3/c22-18(23)14-6-7-15-11-24-19(17(15)10-14,12-21-9-8-20-13-21)16-4-2-1-3-5-16/h1-10,13H,11-12H2,(H,22,23)