3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylazanium

Systemtic Name: 3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylazanium Openeye Name: 3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylammonium CAS Name: 3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylammonium IUPAC Name: 3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylazanium Traditional Name: 3-[7-(diethylsulfamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]propylammonium Formula: C16H28N3O2S+ MolecularWeight: 326.47742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(CCN(C2)CCC[NH3+])C=C1

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(CCN(C2)CCC[NH3+])C=C1

InChI

InChI=1S/C16H27N3O2S/c1-3-19(4-2)22(20,21)16-7-6-14-8-11-18(10-5-9-17)13-15(14)12-16/h6-7,12H,3-5,8-11,13,17H2,1-2H3/p+1