2,5-dimethyl-N-(4-methylphenyl)sulfonyl-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-(4-methylphenyl)sulfonyl-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrrole-3-carboxamide Openeye Name: 2,5-dimethyl-N-(p-tolylsulfonyl)-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-N-(4-methylphenyl)sulfonyl-1-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-N-(4-methylphenyl)sulfonyl-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrrole-3-carboxamide Traditional Name: 2,5-dimethyl-1-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-N-tosyl-pyrrole-3-carboxamide Formula: C23H34N3O3S+ MolecularWeight: 432.59936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(N(C(=C2)C)C3CC([NH2+]C(C3)(C)C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(N(C(=C2)C)C3CC([NH2+]C(C3)(C)C)(C)C)C

InChI

InChI=1S/C23H33N3O3S/c1-15-8-10-19(11-9-15)30(28,29)24-21(27)20-12-16(2)26(17(20)3)18-13-22(4,5)25-23(6,7)14-18/h8-12,18,25H,13-14H2,1-7H3,(H,24,27)/p+1