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

Systemtic Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[methyl-(1-methyl-4-piperidin-1-iumyl)sulfamoyl]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-3-phenyl-propionamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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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)CCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-24-16-14-20(15-17-24)25(2)29(27,28)21-11-9-19(10-12-21)23-22(26)13-8-18-6-4-3-5-7-18/h3-7,9-12,20H,8,13-17H2,1-2H3,(H,23,26)/p+1