1-[[3-fluoranyl-4-[5-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]-3-oxidanyl-azetidine-3-carboxylic acid

Systemtic Name: 1-[[3-fluoranyl-4-[5-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]-3-oxidanyl-azetidine-3-carboxylic acid Openeye Name: 1-[[3-fluoro-4-[5-(1-phenylcyclopropyl)benzofuran-2-yl]phenyl]methyl]-3-hydroxy-azetidine-3-carboxylic acid CAS Name: 1-[[3-fluoro-4-[5-(1-phenylcyclopropyl)-2-benzofuranyl]phenyl]methyl]-3-hydroxy-3-azetidinecarboxylic acid IUPAC Name: 1-[[3-fluoro-4-[5-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]-3-hydroxyazetidine-3-carboxylic acid Traditional Name: 1-[3-fluoro-4-[5-(1-phenylcyclopropyl)benzofuran-2-yl]benzyl]-3-hydroxy-azetidine-3-carboxylic acid Formula: C28H24FNO4 MolecularWeight: 457.492863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=CC=C2)C3=CC4=C(C=C3)OC(=C4)C5=C(C=C(C=C5)CN6CC(C6)(C(=O)O)O)F

Isomeric SMILES

C1CC1(C2=CC=CC=C2)C3=CC4=C(C=C3)OC(=C4)C5=C(C=C(C=C5)CN6CC(C6)(C(=O)O)O)F

InChI

InChI=1S/C28H24FNO4/c29-23-12-18(15-30-16-28(33,17-30)26(31)32)6-8-22(23)25-14-19-13-21(7-9-24(19)34-25)27(10-11-27)20-4-2-1-3-5-20/h1-9,12-14,33H,10-11,15-17H2,(H,31,32)