3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide CAS Name: 3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 3-(tert-butylsulfamoyl)-5-(ethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Formula: C20H35N4O3S+ MolecularWeight: 411.5819

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=CC(=C1)C(=O)NCC2CCC[NH+](C2)C)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CCNC1=CC(=CC(=C1)C(=O)NC[C@H]2CCC[NH+](C2)C)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C20H34N4O3S/c1-6-21-17-10-16(11-18(12-17)28(26,27)23-20(2,3)4)19(25)22-13-15-8-7-9-24(5)14-15/h10-12,15,21,23H,6-9,13-14H2,1-5H3,(H,22,25)/p+1/t15-/m1/s1