2-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenoxy]-N-(1-ethylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenoxy]-N-(1-ethylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenoxy]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)sulfonyl-methylamino]phenoxy]-N-(1-ethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[4-[(4-chlorophenyl)sulfonyl-methylamino]phenoxy]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenoxy]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide Formula: C22H29ClN3O4S+ MolecularWeight: 467.00136

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)COC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O4S/c1-3-26-14-12-18(13-15-26)24-22(27)16-30-20-8-6-19(7-9-20)25(2)31(28,29)21-10-4-17(23)5-11-21/h4-11,18H,3,12-16H2,1-2H3,(H,24,27)/p+1