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

Systemtic Name: 1-[[3-fluoranyl-4-[5-(phenylcarbonyl)-1-benzofuran-2-yl]phenyl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[4-(5-benzoylbenzofuran-2-yl)-3-fluoro-phenyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[4-(5-benzoyl-2-benzofuranyl)-3-fluorophenyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[4-(5-benzoyl-1-benzofuran-2-yl)-3-fluorophenyl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[4-(5-benzoylbenzofuran-2-yl)-3-fluoro-benzyl]azetidine-3-carboxylic acid Formula: C26H20FNO4 MolecularWeight: 429.439703

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1CC2=CC(=C(C=C2)C3=CC4=C(O3)C=CC(=C4)C(=O)C5=CC=CC=C5)F)C(=O)O

Isomeric SMILES

C1C(CN1CC2=CC(=C(C=C2)C3=CC4=C(O3)C=CC(=C4)C(=O)C5=CC=CC=C5)F)C(=O)O

InChI

InChI=1S/C26H20FNO4/c27-22-10-16(13-28-14-20(15-28)26(30)31)6-8-21(22)24-12-19-11-18(7-9-23(19)32-24)25(29)17-4-2-1-3-5-17/h1-12,20H,13-15H2,(H,30,31)