N-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-sulfonamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-sulfonamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-sulfonamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-1-piperazin-4-iumsulfonamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-sulfonamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-sulfonamide Formula: C13H22N3O3S+ MolecularWeight: 300.39708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=C(C=C1)CCNS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H21N3O3S/c1-19-13-4-2-12(3-5-13)6-7-15-20(17,18)16-10-8-14-9-11-16/h2-5,14-15H,6-11H2,1H3/p+1