4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC[C@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C21H27N3O3S/c1-23(2)28(26,27)19-12-10-18(11-13-19)21(25)22-16-20(24-14-6-7-15-24)17-8-4-3-5-9-17/h3-5,8-13,20H,6-7,14-16H2,1-2H3,(H,22,25)/p+1/t20-/m1/s1