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

Systemtic Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[4-[methyl-(1-methyl-4-piperidin-1-iumyl)sulfamoyl]phenyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-(4-nitrophenoxy)acetamide Formula: C21H27N4O6S+ MolecularWeight: 463.52728

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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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O6S/c1-23-13-11-17(12-14-23)24(2)32(29,30)20-9-3-16(4-10-20)22-21(26)15-31-19-7-5-18(6-8-19)25(27)28/h3-10,17H,11-15H2,1-2H3,(H,22,26)/p+1