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

Systemtic Name: N-(butylcarbamoyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(butylcarbamoyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[butylamino(oxo)methyl]-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(butylcarbamoyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(butylcarbamoyl)-2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C18H28N3O4+ MolecularWeight: 350.43262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C[NH+]1CCC2=CC(=C(C=C2C1)OC)OC

Isomeric SMILES

CCCCNC(=O)NC(=O)C[NH+]1CCC2=CC(=C(C=C2C1)OC)OC

InChI

InChI=1S/C18H27N3O4/c1-4-5-7-19-18(23)20-17(22)12-21-8-6-13-9-15(24-2)16(25-3)10-14(13)11-21/h9-10H,4-8,11-12H2,1-3H3,(H2,19,20,22,23)/p+1