2-chloranyl-1-hexadecyl-pyridin-1-ium chloride

Systemtic Name: 2-chloranyl-1-hexadecyl-pyridin-1-ium chloride Openeye Name: 2-chloro-1-hexadecyl-pyridin-1-ium chloride CAS Name: 2-chloro-1-hexadecylpyridin-1-ium chloride IUPAC Name: 2-chloro-1-hexadecylpyridin-1-ium chloride Traditional Name: 1-cetyl-2-chloro-pyridin-1-ium chloride Formula: C21H37Cl2N MolecularWeight: 374.43118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1Cl.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1Cl.[Cl-]

InChI

InChI=1S/C21H37ClN.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-23-20-17-15-18-21(23)22;/h15,17-18,20H,2-14,16,19H2,1H3;1H/q+1;/p-1