1-octyl-4-tridecyl-pyridin-1-ium chloride

Systemtic Name: 1-octyl-4-tridecyl-pyridin-1-ium chloride Openeye Name: 1-octyl-4-tridecyl-pyridin-1-ium chloride CAS Name: 1-octyl-4-tridecylpyridin-1-ium chloride IUPAC Name: 1-octyl-4-tridecylpyridin-1-ium chloride Traditional Name: 1-octyl-4-tridecyl-pyridin-1-ium chloride Formula: C26H48ClN MolecularWeight: 410.11902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CC=[N+](C=C1)CCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC1=CC=[N+](C=C1)CCCCCCCC.[Cl-]

InChI

InChI=1S/C26H48N.ClH/c1-3-5-7-9-11-12-13-14-15-16-18-20-26-21-24-27(25-22-26)23-19-17-10-8-6-4-2;/h21-22,24-25H,3-20,23H2,1-2H3;1H/q+1;/p-1