1-[[3-fluoranyl-4-[6-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[[3-fluoranyl-4-[6-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]pyrrolidine-3-carboxylic acid Openeye Name: 1-[[3-fluoro-4-[6-(1-phenylcyclopropyl)benzofuran-2-yl]phenyl]methyl]pyrrolidine-3-carboxylic acid CAS Name: 1-[[3-fluoro-4-[6-(1-phenylcyclopropyl)-2-benzofuranyl]phenyl]methyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[[3-fluoro-4-[6-(1-phenylcyclopropyl)-1-benzofuran-2-yl]phenyl]methyl]pyrrolidine-3-carboxylic acid Traditional Name: 1-[3-fluoro-4-[6-(1-phenylcyclopropyl)benzofuran-2-yl]benzyl]pyrrolidine-3-carboxylic acid Formula: C29H26FNO3 MolecularWeight: 455.520043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C(=O)O)CC2=CC(=C(C=C2)C3=CC4=C(O3)C=C(C=C4)C5(CC5)C6=CC=CC=C6)F

Isomeric SMILES

C1CN(CC1C(=O)O)CC2=CC(=C(C=C2)C3=CC4=C(O3)C=C(C=C4)C5(CC5)C6=CC=CC=C6)F

InChI

InChI=1S/C29H26FNO3/c30-25-14-19(17-31-13-10-21(18-31)28(32)33)6-9-24(25)27-15-20-7-8-23(16-26(20)34-27)29(11-12-29)22-4-2-1-3-5-22/h1-9,14-16,21H,10-13,17-18H2,(H,32,33)