N-[2-methoxy-5-[[1-(phenylmethyl)piperidin-1-ium-4-yl]sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[2-methoxy-5-[[1-(phenylmethyl)piperidin-1-ium-4-yl]sulfamoyl]phenyl]ethanamide Openeye Name: N-[5-[(1-benzylpiperidin-1-ium-4-yl)sulfamoyl]-2-methoxy-phenyl]acetamide CAS Name: N-[2-methoxy-5-[[1-(phenylmethyl)-4-piperidin-1-iumyl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[5-[(1-benzylpiperidin-1-ium-4-yl)sulfamoyl]-2-methoxyphenyl]acetamide Traditional Name: N-[5-[(1-benzylpiperidin-1-ium-4-yl)sulfamoyl]-2-methoxy-phenyl]acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H27N3O4S/c1-16(25)22-20-14-19(8-9-21(20)28-2)29(26,27)23-18-10-12-24(13-11-18)15-17-6-4-3-5-7-17/h3-9,14,18,23H,10-13,15H2,1-2H3,(H,22,25)/p+1