ethanol; hexyl pyridine-3-carboxylate

Systemtic Name: ethanol; hexyl pyridine-3-carboxylate Openeye Name: ethanol; hexyl pyridine-3-carboxylate CAS Name: ethanol; 3-pyridinecarboxylic acid hexyl ester IUPAC Name: ethanol; hexyl pyridine-3-carboxylate Traditional Name: ethanol; nicotinic acid hexyl ester Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CN=CC=C1.CCO

Isomeric SMILES

CCCCCCOC(=O)C1=CN=CC=C1.CCO

InChI

InChI=1S/C12H17NO2.C2H6O/c1-2-3-4-5-9-15-12(14)11-7-6-8-13-10-11;1-2-3/h6-8,10H,2-5,9H2,1H3;3H,2H2,1H3