1-[2-(3-phenyl-1-benzofuran-2-yl)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(3-phenyl-1-benzofuran-2-yl)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(3-phenylbenzofuran-2-yl)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(3-phenyl-2-benzofuranyl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-phenyl-1-benzofuran-2-yl)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(3-phenylbenzofuran-2-yl)ethyl]nipecotic acid Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=C(C3=CC=CC=C3O2)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCC2=C(C3=CC=CC=C3O2)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H23NO3/c24-22(25)17-9-6-13-23(15-17)14-12-20-21(16-7-2-1-3-8-16)18-10-4-5-11-19(18)26-20/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,24,25)