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

Systemtic Name: 2-(7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylazanium Openeye Name: 2-[7-(1-piperidylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethylammonium CAS Name: 2-[7-(1-piperidinylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethylammonium IUPAC Name: 2-(7-piperidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylazanium Traditional Name: 2-(7-piperidinosulfonyl-3,4-dihydro-1H-isoquinolin-2-yl)ethylammonium Formula: C16H26N3O2S+ MolecularWeight: 324.46154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(CCN(C3)CC[NH3+])C=C2

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(CCN(C3)CC[NH3+])C=C2

InChI

InChI=1S/C16H25N3O2S/c17-7-11-18-10-6-14-4-5-16(12-15(14)13-18)22(20,21)19-8-2-1-3-9-19/h4-5,12H,1-3,6-11,13,17H2/p+1