1-(phenylmethyl)-3-quinolin-2-yl-quinolin-1-ium iodide

Systemtic Name: 1-(phenylmethyl)-3-quinolin-2-yl-quinolin-1-ium iodide Openeye Name: 1-benzyl-3-(2-quinolyl)quinolin-1-ium iodide CAS Name: 1-(phenylmethyl)-3-(2-quinolinyl)quinolin-1-ium iodide IUPAC Name: 1-benzyl-3-quinolin-2-ylquinolin-1-ium iodide Traditional Name: 1-benzyl-3-(2-quinolyl)quinolin-1-ium iodide Formula: C25H19IN2 MolecularWeight: 474.33623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC(=CC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4.[I-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC(=CC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4.[I-]

InChI

InChI=1S/C25H19N2.HI/c1-2-8-19(9-3-1)17-27-18-22(16-21-11-5-7-13-25(21)27)24-15-14-20-10-4-6-12-23(20)26-24;/h1-16,18H,17H2;1H/q+1;/p-1