(2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide

Systemtic Name: (2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide Openeye Name: (2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide CAS Name: (2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide IUPAC Name: (2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanamide Traditional Name: (2S)-N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propionamide Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O/c1-3-15-14(17)11(2)16-9-8-12-6-4-5-7-13(12)10-16/h4-7,11H,3,8-10H2,1-2H3,(H,15,17)/p+1/t11-/m0/s1