(2R)-2-(4-phenethylpiperidin-1-ium-1-yl)-N-(3-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-(4-phenethylpiperidin-1-ium-1-yl)-N-(3-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-(4-phenethylpiperidin-1-ium-1-yl)-N-(3-sulfamoylphenyl)propanamide CAS Name: (2R)-2-(4-phenethyl-1-piperidin-1-iumyl)-N-(3-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-(4-phenethylpiperidin-1-ium-1-yl)-N-(3-sulfamoylphenyl)propanamide Traditional Name: (2R)-2-(4-phenethylpiperidin-1-ium-1-yl)-N-(3-sulfamoylphenyl)propionamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)[NH+]2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)[NH+]2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-17(22(26)24-20-8-5-9-21(16-20)29(23,27)28)25-14-12-19(13-15-25)11-10-18-6-3-2-4-7-18/h2-9,16-17,19H,10-15H2,1H3,(H,24,26)(H2,23,27,28)/p+1/t17-/m1/s1