2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylsulfonylphenyl)acetamide CAS Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-[(1R)-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-mesylphenyl)acetamide Formula: C26H29N2O5S+ MolecularWeight: 481.58386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C([NH+](CCC2=C1)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H]([NH+](CCC2=C1)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H28N2O5S/c1-32-23-15-19-13-14-28(17-25(29)27-20-9-11-21(12-10-20)34(3,30)31)26(18-7-5-4-6-8-18)22(19)16-24(23)33-2/h4-12,15-16,26H,13-14,17H2,1-3H3,(H,27,29)/p+1/t26-/m1/s1