N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-methyl-acetamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C[NH+]1CCCC1C2=C(C=C(C=C2)OC)OC)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)C[NH+]1CCC[C@@H]1C2=C(C=C(C=C2)OC)OC)C3(CCCCC3)C#N

InChI

InChI=1S/C22H31N3O3/c1-24(22(16-23)11-5-4-6-12-22)21(26)15-25-13-7-8-19(25)18-10-9-17(27-2)14-20(18)28-3/h9-10,14,19H,4-8,11-13,15H2,1-3H3/p+1/t19-/m1/s1