3-(12-chloranyldodecyl)-1-oct-7-enyl-pyridin-1-ium chloride

Systemtic Name: 3-(12-chloranyldodecyl)-1-oct-7-enyl-pyridin-1-ium chloride Openeye Name: 3-(12-chlorododecyl)-1-oct-7-enyl-pyridin-1-ium chloride CAS Name: 3-(12-chlorododecyl)-1-oct-7-enylpyridin-1-ium chloride IUPAC Name: 3-(12-chlorododecyl)-1-oct-7-enylpyridin-1-ium chloride Traditional Name: 3-(12-chlorododecyl)-1-oct-7-enyl-pyridin-1-ium chloride Formula: C25H43Cl2N MolecularWeight: 428.52162

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCC[N+]1=CC=CC(=C1)CCCCCCCCCCCCCl.[Cl-]

Isomeric SMILES

C=CCCCCCC[N+]1=CC=CC(=C1)CCCCCCCCCCCCCl.[Cl-]

InChI

InChI=1S/C25H43ClN.ClH/c1-2-3-4-5-14-17-22-27-23-18-20-25(24-27)19-15-12-10-8-6-7-9-11-13-16-21-26;/h2,18,20,23-24H,1,3-17,19,21-22H2;1H/q+1;/p-1