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

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

Systemtic Name:3-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol
Openeye Name:3-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)vinyl]phenol
CAS Name:3-[(E)-2-(1-dodecyl-2-pyridin-1-iumyl)ethenyl]phenol
IUPAC Name:3-[(E)-2-(1-dodecylpyridin-1-ium-2-yl)ethenyl]phenol
Traditional Name:3-[(E)-2-(1-laurylpyridin-1-ium-2-yl)vinyl]phenol
Formula: C25H36NO+
MolecularWeight: 366.55944
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC=C1C=CC2=CC(=CC=C2)O


Isomeric SMILES

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


InChI

InChI=1S/C25H35NO/c1-2-3-4-5-6-7-8-9-10-12-20-26-21-13-11-16-24(26)19-18-23-15-14-17-25(27)22-23/h11,13-19,21-22H,2-10,12,20H2,1H3/p+1/b19-18+


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