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

Systemtic Name: 1-(3-chloranylpropyl)-3-quinolin-2-yl-quinolin-1-ium iodide Openeye Name: 1-(3-chloropropyl)-3-(2-quinolyl)quinolin-1-ium iodide CAS Name: 1-(3-chloropropyl)-3-(2-quinolinyl)quinolin-1-ium iodide IUPAC Name: 1-(3-chloropropyl)-3-quinolin-2-ylquinolin-1-ium iodide Traditional Name: 1-(3-chloropropyl)-3-(2-quinolyl)quinolin-1-ium iodide Formula: C21H18ClIN2 MolecularWeight: 460.73849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=CC4=CC=CC=C4[N+](=C3)CCCCl.[I-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=CC4=CC=CC=C4[N+](=C3)CCCCl.[I-]

InChI

InChI=1S/C21H18ClN2.HI/c22-12-5-13-24-15-18(14-17-7-2-4-9-21(17)24)20-11-10-16-6-1-3-8-19(16)23-20;/h1-4,6-11,14-15H,5,12-13H2;1H/q+1;/p-1