1-(2-methylprop-2-enyl)-3-quinolin-2-yl-quinolin-1-ium iodide

Systemtic Name: 1-(2-methylprop-2-enyl)-3-quinolin-2-yl-quinolin-1-ium iodide Openeye Name: 1-(2-methylallyl)-3-(2-quinolyl)quinolin-1-ium iodide CAS Name: 1-(2-methylprop-2-enyl)-3-(2-quinolinyl)quinolin-1-ium iodide IUPAC Name: 1-(2-methylprop-2-enyl)-3-quinolin-2-ylquinolin-1-ium iodide Traditional Name: 1-(2-methylallyl)-3-(2-quinolyl)quinolin-1-ium iodide Formula: C22H19IN2 MolecularWeight: 438.30413

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[N+]1=CC(=CC2=CC=CC=C21)C3=NC4=CC=CC=C4C=C3.[I-]

Isomeric SMILES

CC(=C)C[N+]1=CC(=CC2=CC=CC=C21)C3=NC4=CC=CC=C4C=C3.[I-]

InChI

InChI=1S/C22H19N2.HI/c1-16(2)14-24-15-19(13-18-8-4-6-10-22(18)24)21-12-11-17-7-3-5-9-20(17)23-21;/h3-13,15H,1,14H2,2H3;1H/q+1;/p-1