hexadecyl pyridine-3-carboxylate

Systemtic Name: hexadecyl pyridine-3-carboxylate Openeye Name: hexadecyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid hexadecyl ester IUPAC Name: hexadecyl pyridine-3-carboxylate Traditional Name: nicotinic acid cetyl ester Formula: C22H37NO2 MolecularWeight: 347.53468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CN=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CN=CC=C1

InChI

InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25-22(24)21-17-16-18-23-20-21/h16-18,20H,2-15,19H2,1H3