2-[(phenylmethyl)-propylsulfonyl-amino]ethylazanium

Systemtic Name: 2-[(phenylmethyl)-propylsulfonyl-amino]ethylazanium Openeye Name: 2-[benzyl(propylsulfonyl)amino]ethylammonium CAS Name: 2-[(phenylmethyl)-propylsulfonylamino]ethylammonium IUPAC Name: 2-[benzyl(propylsulfonyl)amino]ethylazanium Traditional Name: 2-[benzyl(propylsulfonyl)amino]ethylammonium Formula: C12H21N2O2S+ MolecularWeight: 257.37234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CC[NH3+])CC1=CC=CC=C1

Isomeric SMILES

CCCS(=O)(=O)N(CC[NH3+])CC1=CC=CC=C1

InChI

InChI=1S/C12H20N2O2S/c1-2-10-17(15,16)14(9-8-13)11-12-6-4-3-5-7-12/h3-7H,2,8-11,13H2,1H3/p+1