2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(p-tolyl)acetamide CAS Name: 2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl]-N-(p-tolyl)acetamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1CC(=O)NC3=CC=C(C=C3)C)OC)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CC[NH+]1CC(=O)NC3=CC=C(C=C3)C)OC)OC

InChI

InChI=1S/C21H26N2O3/c1-14-5-7-17(8-6-14)22-21(24)13-23-10-9-16-11-19(25-3)20(26-4)12-18(16)15(23)2/h5-8,11-12,15H,9-10,13H2,1-4H3,(H,22,24)/p+1/t15-/m0/s1