N-[(3,4-dimethoxyphenyl)methyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-veratryl-acetamide Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C[NH+]2CCC3=CC=CC=C3C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C[NH+]2CCC3=CC=CC=C3C2)OC

InChI

InChI=1S/C20H24N2O3/c1-24-18-8-7-15(11-19(18)25-2)12-21-20(23)14-22-10-9-16-5-3-4-6-17(16)13-22/h3-8,11H,9-10,12-14H2,1-2H3,(H,21,23)/p+1