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heptyl pyridine-3-carboxylate

heptyl pyridine-3-carboxylate

Systemtic Name:heptyl pyridine-3-carboxylate
Openeye Name:heptyl pyridine-3-carboxylate
CAS Name:3-pyridinecarboxylic acid heptyl ester
IUPAC Name:heptyl pyridine-3-carboxylate
Traditional Name:nicotinic acid heptyl ester
Formula: C13H19NO2
MolecularWeight: 221.29546
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CN=CC=C1


Isomeric SMILES

CCCCCCCOC(=O)C1=CN=CC=C1


InChI

InChI=1S/C13H19NO2/c1-2-3-4-5-6-10-16-13(15)12-8-7-9-14-11-12/h7-9,11H,2-6,10H2,1H3


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