N-(2-cyanopropan-2-yl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(2-cyanopropan-2-yl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(1-cyano-1-methyl-ethyl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(2-cyanopropan-2-yl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(2-cyanopropan-2-yl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(1-cyano-1-methyl-ethyl)-N-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)N(C)C(=O)C[NH+]1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(C)(C#N)N(C)C(=O)C[NH+]1CCC2=CC=CC=C2C1

InChI

InChI=1S/C16H21N3O/c1-16(2,12-17)18(3)15(20)11-19-9-8-13-6-4-5-7-14(13)10-19/h4-7H,8-11H2,1-3H3/p+1