N-(4-methyl-3-sulfamoyl-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methyl-3-sulfamoyl-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(4-methyl-3-sulfamoyl-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide CAS Name: N-(4-methyl-3-sulfamoylphenyl)-2-(4-phenethyl-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(4-methyl-3-sulfamoylphenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-(4-methyl-3-sulfamoyl-phenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)acetamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C22H29N3O3S/c1-17-7-10-20(15-21(17)29(23,27)28)24-22(26)16-25-13-11-19(12-14-25)9-8-18-5-3-2-4-6-18/h2-7,10,15,19H,8-9,11-14,16H2,1H3,(H,24,26)(H2,23,27,28)/p+1