1-[2-(4-dodecylphenyl)ethyl]pyridin-1-ium chloride

Systemtic Name: 1-[2-(4-dodecylphenyl)ethyl]pyridin-1-ium chloride Openeye Name: 1-[2-(4-dodecylphenyl)ethyl]pyridin-1-ium chloride CAS Name: 1-[2-(4-dodecylphenyl)ethyl]pyridin-1-ium chloride IUPAC Name: 1-[2-(4-dodecylphenyl)ethyl]pyridin-1-ium chloride Traditional Name: 1-[2-(4-laurylphenyl)ethyl]pyridin-1-ium chloride Formula: C25H38ClN MolecularWeight: 388.02892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)CC[N+]2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)CC[N+]2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C25H38N.ClH/c1-2-3-4-5-6-7-8-9-10-12-15-24-16-18-25(19-17-24)20-23-26-21-13-11-14-22-26;/h11,13-14,16-19,21-22H,2-10,12,15,20,23H2,1H3;1H/q+1;/p-1