2-(7-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylazanium

Systemtic Name: 2-(7-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylazanium Openeye Name: 2-(7-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylammonium CAS Name: 2-[7-(1-pyrrolidinylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethylammonium IUPAC Name: 2-(7-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylazanium Traditional Name: 2-(7-pyrrolidinosulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylammonium Formula: C15H24N3O2S+ MolecularWeight: 310.43496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(CCN(C3)CC[NH3+])C=C2

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(CCN(C3)CC[NH3+])C=C2

InChI

InChI=1S/C15H23N3O2S/c16-6-10-17-9-5-13-3-4-15(11-14(13)12-17)21(19,20)18-7-1-2-8-18/h3-4,11H,1-2,5-10,12,16H2/p+1