[(1S)-6,7,8-trimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methylazanium

Systemtic Name: [(1S)-6,7,8-trimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methylazanium Openeye Name: [(1S)-6,7,8-trimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methylammonium CAS Name: [(1S)-6,7,8-trimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methylammonium IUPAC Name: [(1S)-6,7,8-trimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methylazanium Traditional Name: [(1S)-2-mesyl-6,7,8-trimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methylammonium Formula: C14H23N2O5S+ MolecularWeight: 331.40782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(N(CCC2=C1)S(=O)(=O)C)C[NH3+])OC)OC

Isomeric SMILES

COC1=C(C(=C2[C@H](N(CCC2=C1)S(=O)(=O)C)C[NH3+])OC)OC

InChI

InChI=1S/C14H22N2O5S/c1-19-11-7-9-5-6-16(22(4,17)18)10(8-15)12(9)14(21-3)13(11)20-2/h7,10H,5-6,8,15H2,1-4H3/p+1/t10-/m1/s1