2-ethylhexyl pyridine-4-carboxylate

Systemtic Name: 2-ethylhexyl pyridine-4-carboxylate Openeye Name: 2-ethylhexyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl pyridine-4-carboxylate Traditional Name: isonicotinic acid 2-ethylhexyl ester Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC=NC=C1

Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC=NC=C1

InChI

InChI=1S/C14H21NO2/c1-3-5-6-12(4-2)11-17-14(16)13-7-9-15-10-8-13/h7-10,12H,3-6,11H2,1-2H3