N-[3-methyl-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methylsulfamoyl]phenyl]propanamide

Systemtic Name: N-[3-methyl-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]methylsulfamoyl]phenyl]propanamide Openeye Name: N-[4-[(1-benzylpiperidin-1-ium-4-yl)methylsulfamoyl]-3-methyl-phenyl]propanamide CAS Name: N-[3-methyl-4-[[1-(phenylmethyl)-4-piperidin-1-iumyl]methylsulfamoyl]phenyl]propanamide IUPAC Name: N-[4-[(1-benzylpiperidin-1-ium-4-yl)methylsulfamoyl]-3-methylphenyl]propanamide Traditional Name: N-[4-[(1-benzylpiperidin-1-ium-4-yl)methylsulfamoyl]-3-methyl-phenyl]propionamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3O3S/c1-3-23(27)25-21-9-10-22(18(2)15-21)30(28,29)24-16-19-11-13-26(14-12-19)17-20-7-5-4-6-8-20/h4-10,15,19,24H,3,11-14,16-17H2,1-2H3,(H,25,27)/p+1