2-(4-methylsulfonylpiperazin-1-ium-1-yl)-N-(3-phenylmethoxypropyl)ethanamide

Systemtic Name: 2-(4-methylsulfonylpiperazin-1-ium-1-yl)-N-(3-phenylmethoxypropyl)ethanamide Openeye Name: N-(3-benzyloxypropyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: 2-(4-methylsulfonyl-1-piperazin-1-iumyl)-N-(3-phenylmethoxypropyl)acetamide IUPAC Name: 2-(4-methylsulfonylpiperazin-1-ium-1-yl)-N-(3-phenylmethoxypropyl)acetamide Traditional Name: N-(3-benzoxypropyl)-2-(4-mesylpiperazin-1-ium-1-yl)acetamide Formula: C17H28N3O4S+ MolecularWeight: 370.48692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NCCCOCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NCCCOCC2=CC=CC=C2

InChI

InChI=1S/C17H27N3O4S/c1-25(22,23)20-11-9-19(10-12-20)14-17(21)18-8-5-13-24-15-16-6-3-2-4-7-16/h2-4,6-7H,5,8-15H2,1H3,(H,18,21)/p+1