2-[(4-bromophenyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Traditional Name: 2-(brosylamino)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzamide Formula: C22H29BrN3O3S+ MolecularWeight: 495.45296

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H28BrN3O3S/c1-21(2)13-16(14-22(3,4)26-21)24-20(27)18-7-5-6-8-19(18)25-30(28,29)17-11-9-15(23)10-12-17/h5-12,16,25-26H,13-14H2,1-4H3,(H,24,27)/p+1