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4-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol bromide

4-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol bromide

Systemtic Name:4-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol bromide
Openeye Name:4-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)vinyl]phenol bromide
CAS Name:4-[(E)-2-(1-dodecyl-2-pyridin-1-iumyl)ethenyl]phenol bromide
IUPAC Name:4-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol bromide
Traditional Name:4-[(E)-2-(1-laurylpyridin-1-ium-2-yl)vinyl]phenol bromide
Formula: C25H36BrNO
MolecularWeight: 446.46344
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)O.[Br-]


Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=CC=C1/C=C/C2=CC=C(C=C2)O.[Br-]


InChI

InChI=1S/C25H35NO.BrH/c1-2-3-4-5-6-7-8-9-10-12-21-26-22-13-11-14-24(26)18-15-23-16-19-25(27)20-17-23;/h11,13-20,22H,2-10,12,21H2,1H3;1H


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