2-[(1R)-6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethylazanium

Systemtic Name: 2-[(1R)-6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethylazanium Openeye Name: 2-[(1R)-6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethylammonium CAS Name: 2-[(1R)-6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethylammonium IUPAC Name: 2-[(1R)-6,7-dimethoxy-2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethylazanium Traditional Name: 2-[(1R)-2-mesyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethylammonium Formula: C14H23N2O4S+ MolecularWeight: 315.40842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O4S/c1-19-13-8-10-5-7-16(21(3,17)18)12(4-6-15)11(10)9-14(13)20-2/h8-9,12H,4-7,15H2,1-3H3/p+1/t12-/m1/s1