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

Systemtic Name: 3-(diethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]benzamide Openeye Name: 3-(diethylsulfamoyl)-N-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]benzamide CAS Name: 3-(diethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)-2-morpholin-4-iumyl]methyl]benzamide IUPAC Name: 3-(diethylsulfamoyl)-N-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]benzamide Traditional Name: 3-(diethylsulfamoyl)-N-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]benzamide Formula: C20H34N3O4S+ MolecularWeight: 412.56666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NCC2C[NH+](CCO2)CC(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC[C@H]2C[NH+](CCO2)CC(C)C

InChI

InChI=1S/C20H33N3O4S/c1-5-23(6-2)28(25,26)19-9-7-8-17(12-19)20(24)21-13-18-15-22(10-11-27-18)14-16(3)4/h7-9,12,16,18H,5-6,10-11,13-15H2,1-4H3,(H,21,24)/p+1/t18-/m0/s1