N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-phenoxy-ethanamide Openeye Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-phenoxy-acetamide CAS Name: N-[4-[methyl-(1-methyl-4-piperidin-1-iumyl)sulfamoyl]phenyl]-2-phenoxyacetamide IUPAC Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-phenoxyacetamide Traditional Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-phenoxy-acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-23-14-12-18(13-15-23)24(2)29(26,27)20-10-8-17(9-11-20)22-21(25)16-28-19-6-4-3-5-7-19/h3-11,18H,12-16H2,1-2H3,(H,22,25)/p+1