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2-pyridin-1-ium-1-ylethyl ethanoate

2-pyridin-1-ium-1-ylethyl ethanoate

Systemtic Name:2-pyridin-1-ium-1-ylethyl ethanoate
Openeye Name:2-pyridin-1-ium-1-ylethyl acetate
CAS Name:acetic acid 2-(1-pyridin-1-iumyl)ethyl ester
IUPAC Name:2-pyridin-1-ium-1-ylethyl acetate
Traditional Name:acetic acid 2-pyridin-1-ium-1-ylethyl ester
Formula: C9H12NO2+
MolecularWeight: 166.19708
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[N+]1=CC=CC=C1


Isomeric SMILES

CC(=O)OCC[N+]1=CC=CC=C1


InChI

InChI=1S/C9H12NO2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3/q+1


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