(4,5-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl) 2-(1-benzofuran-2-yl)ethanoate

Systemtic Name: (4,5-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl) 2-(1-benzofuran-2-yl)ethanoate Openeye Name: (4,5-dimethoxy-2-pyrrolidin-1-yl-cyclohexyl) 2-(benzofuran-2-yl)acetate CAS Name: 2-(2-benzofuranyl)acetic acid [4,5-dimethoxy-2-(1-pyrrolidinyl)cyclohexyl] ester IUPAC Name: (4,5-dimethoxy-2-pyrrolidin-1-ylcyclohexyl) 2-(1-benzofuran-2-yl)acetate Traditional Name: 2-(benzofuran-2-yl)acetic acid (4,5-dimethoxy-2-pyrrolidino-cyclohexyl) ester Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(C(CC1OC)OC(=O)CC2=CC3=CC=CC=C3O2)N4CCCC4

Isomeric SMILES

COC1CC(C(CC1OC)OC(=O)CC2=CC3=CC=CC=C3O2)N4CCCC4

InChI

InChI=1S/C22H29NO5/c1-25-20-13-17(23-9-5-6-10-23)19(14-21(20)26-2)28-22(24)12-16-11-15-7-3-4-8-18(15)27-16/h3-4,7-8,11,17,19-21H,5-6,9-10,12-14H2,1-2H3