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

Systemtic Name: 5-chloranyl-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 2-benzyl-5-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 5-chloro-1-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 2-benzyl-5-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 2-benzyl-5-chloro-1-phenyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C22H19ClIN MolecularWeight: 459.75043

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