2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride

Systemtic Name: 2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride Openeye Name: 2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride CAS Name: 2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride IUPAC Name: 2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride Traditional Name: 2-amyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride Formula: C14H22ClN MolecularWeight: 239.78418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+]1CCC2=CC=CC=C2C1.[Cl-]

Isomeric SMILES

CCCCC[NH+]1CCC2=CC=CC=C2C1.[Cl-]

InChI

InChI=1S/C14H21N.ClH/c1-2-3-6-10-15-11-9-13-7-4-5-8-14(13)12-15;/h4-5,7-8H,2-3,6,9-12H2,1H3;1H