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

Systemtic Name: 2-[(1R)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N-pyridin-4-yl-ethanamide Openeye Name: 2-[(1R)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N-(4-pyridyl)acetamide CAS Name: 2-[(1R)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N-pyridin-4-ylacetamide IUPAC Name: 2-[(1R)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N-pyridin-4-ylacetamide Traditional Name: 2-[(1R)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N-(4-pyridyl)acetamide Formula: C17H20N3O+ MolecularWeight: 282.3602

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=CC=CC=C2C1CC(=O)NC3=CC=NC=C3

Isomeric SMILES

C[NH+]1CCC2=CC=CC=C2[C@H]1CC(=O)NC3=CC=NC=C3

InChI

InChI=1S/C17H19N3O/c1-20-11-8-13-4-2-3-5-15(13)16(20)12-17(21)19-14-6-9-18-10-7-14/h2-7,9-10,16H,8,11-12H2,1H3,(H,18,19,21)/p+1/t16-/m1/s1