1-[2-(3-chloranylpropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride

Systemtic Name: 1-[2-(3-chloranylpropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride Openeye Name: 1-[2-(3-chloropropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride CAS Name: 1-[2-(3-chloropropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride IUPAC Name: 1-[2-(3-chloropropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride Traditional Name: 1-[2-(3-chloropropyl)phenyl]-3,4-dihydroisoquinolin-2-ium chloride Formula: C18H19Cl2N MolecularWeight: 320.25616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(C2=CC=CC=C21)C3=CC=CC=C3CCCCl.[Cl-]

Isomeric SMILES

C1C[NH+]=C(C2=CC=CC=C21)C3=CC=CC=C3CCCCl.[Cl-]

InChI

InChI=1S/C18H18ClN.ClH/c19-12-5-8-14-6-1-3-9-16(14)18-17-10-4-2-7-15(17)11-13-20-18;/h1-4,6-7,9-10H,5,8,11-13H2;1H