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

Systemtic Name: 1-[[4-[5-(cyclopropylmethoxy)-1-benzofuran-2-yl]-3-fluoranyl-phenyl]methyl]azetidine-3-carboxylic acid Openeye Name: 1-[[4-[5-(cyclopropylmethoxy)benzofuran-2-yl]-3-fluoro-phenyl]methyl]azetidine-3-carboxylic acid CAS Name: 1-[[4-[5-(cyclopropylmethoxy)-2-benzofuranyl]-3-fluorophenyl]methyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[[4-[5-(cyclopropylmethoxy)-1-benzofuran-2-yl]-3-fluorophenyl]methyl]azetidine-3-carboxylic acid Traditional Name: 1-[4-[5-(cyclopropylmethoxy)benzofuran-2-yl]-3-fluoro-benzyl]azetidine-3-carboxylic acid Formula: C23H22FNO4 MolecularWeight: 395.423483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)F

Isomeric SMILES

C1CC1COC2=CC3=C(C=C2)OC(=C3)C4=C(C=C(C=C4)CN5CC(C5)C(=O)O)F

InChI

InChI=1S/C23H22FNO4/c24-20-7-15(10-25-11-17(12-25)23(26)27)3-5-19(20)22-9-16-8-18(4-6-21(16)29-22)28-13-14-1-2-14/h3-9,14,17H,1-2,10-13H2,(H,26,27)