(2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanamide

Systemtic Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanamide Openeye Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanamide CAS Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanamide IUPAC Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butanamide Traditional Name: (2S)-3-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)butyramide Formula: C14H21N2O+ MolecularWeight: 233.32934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O/c1-10(2)13(14(15)17)16-8-7-11-5-3-4-6-12(11)9-16/h3-6,10,13H,7-9H2,1-2H3,(H2,15,17)/p+1/t13-/m0/s1