(1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1R)-6,7-dimethoxy-1-methyl-2-(3-phenylprop-2-ynyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C21H24NO2+ MolecularWeight: 322.42076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC#CC3=CC=CC=C3)OC)OC

Isomeric SMILES

C[C@@H]1C2=CC(=C(C=C2CC[NH+]1CC#CC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H23NO2/c1-16-19-15-21(24-3)20(23-2)14-18(19)11-13-22(16)12-7-10-17-8-5-4-6-9-17/h4-6,8-9,14-16H,11-13H2,1-3H3/p+1/t16-/m1/s1