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

Systemtic Name: 1-[[3-fluoranyl-4-[5-(oxan-4-yl)-1-benzofuran-2-yl]phenyl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[3-fluoro-4-(5-tetrahydropyran-4-ylbenzofuran-2-yl)phenyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[3-fluoro-4-[5-(4-oxanyl)-2-benzofuranyl]phenyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[3-fluoro-4-[5-(oxan-4-yl)-1-benzofuran-2-yl]phenyl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[3-fluoro-4-(5-tetrahydropyran-4-ylbenzofuran-2-yl)benzyl]azetidine-3-carboxylic acid Formula: C24H24FNO4 MolecularWeight: 409.450063

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)F

Isomeric SMILES

C1COCCC1C2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)F

InChI

InChI=1S/C24H24FNO4/c25-21-9-15(12-26-13-19(14-26)24(27)28)1-3-20(21)23-11-18-10-17(2-4-22(18)30-23)16-5-7-29-8-6-16/h1-4,9-11,16,19H,5-8,12-14H2,(H,27,28)