N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide

Systemtic Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide Openeye Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide CAS Name: N-[4-[methyl-(1-methyl-4-piperidin-1-iumyl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide IUPAC Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide Traditional Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propionamide Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N(C)C3CC[NH+](CC3)C

InChI

InChI=1S/C23H31N3O4S/c1-18-6-4-5-7-22(18)30-17-14-23(27)24-19-8-10-21(11-9-19)31(28,29)26(3)20-12-15-25(2)16-13-20/h4-11,20H,12-17H2,1-3H3,(H,24,27)/p+1