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8-pyridin-1-ium-1-yloctanoate

8-pyridin-1-ium-1-yloctanoate

Systemtic Name:8-pyridin-1-ium-1-yloctanoate
Openeye Name:8-pyridin-1-ium-1-yloctanoate
CAS Name:8-(1-pyridin-1-iumyl)octanoate
IUPAC Name:8-pyridin-1-ium-1-yloctanoate
Traditional Name:8-pyridin-1-ium-1-ylcaprylate
Formula: C13H19NO2
MolecularWeight: 221.29546
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCCCCCCC(=O)[O-]


Isomeric SMILES

C1=CC=[N+](C=C1)CCCCCCCC(=O)[O-]


InChI

InChI=1S/C13H19NO2/c15-13(16)9-5-2-1-3-6-10-14-11-7-4-8-12-14/h4,7-8,11-12H,1-3,5-6,9-10H2


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