1-hexadecylquinolin-1-ium iodide

Systemtic Name: 1-hexadecylquinolin-1-ium iodide Openeye Name: 1-hexadecylquinolin-1-ium iodide CAS Name: 1-hexadecylquinolin-1-ium iodide IUPAC Name: 1-hexadecylquinolin-1-ium iodide Traditional Name: 1-cetylquinolin-1-ium iodide Formula: C25H40IN MolecularWeight: 481.49627

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=CC2=CC=CC=C21.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=CC2=CC=CC=C21.[I-]

InChI

InChI=1S/C25H40N.HI/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-22-26-23-18-20-24-19-15-16-21-25(24)26;/h15-16,18-21,23H,2-14,17,22H2,1H3;1H/q+1;/p-1