2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-N-(4-pyrrolidinophenyl)acetamide Formula: C25H34N3O3+ MolecularWeight: 424.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C[NH+](CCC2=C1)CC(=O)NC3=CC=C(C=C3)N4CCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C2C[NH+](CCC2=C1)CC(=O)NC3=CC=C(C=C3)N4CCCC4)OCC

InChI

InChI=1S/C25H33N3O3/c1-3-30-23-15-19-11-14-27(17-20(19)16-24(23)31-4-2)18-25(29)26-21-7-9-22(10-8-21)28-12-5-6-13-28/h7-10,15-16H,3-6,11-14,17-18H2,1-2H3,(H,26,29)/p+1