7-chloranyl-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 7-chloranyl-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 2-benzyl-7-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 7-chloro-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 2-benzyl-7-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 2-benzyl-7-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C22H19ClIN MolecularWeight: 459.75043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)CC4=CC=CC=C4.[I-]

Isomeric SMILES

C1C[N+](=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)CC4=CC=CC=C4.[I-]

InChI

InChI=1S/C22H19ClN.HI/c23-20-12-11-18-13-14-24(16-17-7-3-1-4-8-17)22(21(18)15-20)19-9-5-2-6-10-19;/h1-12,15H,13-14,16H2;1H/q+1;/p-1