2-(4-chloranylphenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[(2R)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide Formula: C22H29ClN3O2+ MolecularWeight: 402.93756

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)COC2=CC=C(C=C2)Cl)[NH+]3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC=C(C=C2)Cl)[NH+]3CCCC3

InChI

InChI=1S/C22H28ClN3O2/c1-25(2)19-9-5-17(6-10-19)21(26-13-3-4-14-26)15-24-22(27)16-28-20-11-7-18(23)8-12-20/h5-12,21H,3-4,13-16H2,1-2H3,(H,24,27)/p+1/t21-/m0/s1