2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(3,5-dimethylphenyl)acetamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC)C

InChI

InChI=1S/C21H26N2O3/c1-14-7-15(2)9-18(8-14)22-21(24)13-23-6-5-16-10-19(25-3)20(26-4)11-17(16)12-23/h7-11H,5-6,12-13H2,1-4H3,(H,22,24)/p+1