4-(dimethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)-2-morpholin-4-iumyl]methyl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]benzamide Formula: C18H30N3O4S+ MolecularWeight: 384.5135

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCOC(C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)C[NH+]1CCO[C@H](C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C18H29N3O4S/c1-14(2)12-21-9-10-25-16(13-21)11-19-18(22)15-5-7-17(8-6-15)26(23,24)20(3)4/h5-8,14,16H,9-13H2,1-4H3,(H,19,22)/p+1/t16-/m0/s1