(2R)-N-(3,5-dimethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(3,5-dimethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-ethanamide Openeye Name: (2R)-N-(3,5-dimethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-acetamide CAS Name: (2R)-N-(3,5-dimethylphenyl)-2-(4-ethyl-1-piperazin-1-iumyl)-2-phenylacetamide IUPAC Name: (2R)-N-(3,5-dimethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenylacetamide Traditional Name: (2R)-N-(3,5-dimethylphenyl)-2-(4-ethylpiperazin-1-ium-1-yl)-2-phenyl-acetamide Formula: C22H30N3O+ MolecularWeight: 352.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)C(C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCN1CC[NH+](CC1)[C@H](C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C22H29N3O/c1-4-24-10-12-25(13-11-24)21(19-8-6-5-7-9-19)22(26)23-20-15-17(2)14-18(3)16-20/h5-9,14-16,21H,4,10-13H2,1-3H3,(H,23,26)/p+1/t21-/m1/s1