N-(3-chloranyl-4-methyl-phenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C20H24ClN2O3+ MolecularWeight: 375.86916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3/c1-13-4-5-16(10-17(13)21)22-20(24)12-23-7-6-14-8-18(25-2)19(26-3)9-15(14)11-23/h4-5,8-10H,6-7,11-12H2,1-3H3,(H,22,24)/p+1