2-[(3-methoxyphenyl)-propylsulfonyl-amino]ethylazanium

Systemtic Name: 2-[(3-methoxyphenyl)-propylsulfonyl-amino]ethylazanium Openeye Name: 2-(3-methoxy-N-propylsulfonyl-anilino)ethylammonium CAS Name: 2-(3-methoxy-N-propylsulfonylanilino)ethylammonium IUPAC Name: 2-(3-methoxy-N-propylsulfonylanilino)ethylazanium Traditional Name: 2-(3-methoxy-N-propylsulfonyl-anilino)ethylammonium Formula: C12H21N2O3S+ MolecularWeight: 273.37174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O3S/c1-3-9-18(15,16)14(8-7-13)11-5-4-6-12(10-11)17-2/h4-6,10H,3,7-9,13H2,1-2H3/p+1