N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenoxy-ethanamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenoxy-acetamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-phenoxyacetamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-ylethyl]-2-phenoxyacetamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenoxy-acetamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)COC2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C22H29N3O3/c1-24(2)19-10-8-18(9-11-19)21(25-12-14-27-15-13-25)16-23-22(26)17-28-20-6-4-3-5-7-20/h3-11,21H,12-17H2,1-2H3,(H,23,26)/p+1/t21-/m0/s1