hexadecan-4-yl pyridine-3-carboxylate

Systemtic Name: hexadecan-4-yl pyridine-3-carboxylate Openeye Name: 1-propyltridecyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl pyridine-3-carboxylate Traditional Name: nicotinic acid 1-propyltridecyl ester Formula: C22H37NO2 MolecularWeight: 347.53468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)C1=CN=CC=C1

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)C1=CN=CC=C1

InChI

InChI=1S/C22H37NO2/c1-3-5-6-7-8-9-10-11-12-13-17-21(15-4-2)25-22(24)20-16-14-18-23-19-20/h14,16,18-19,21H,3-13,15,17H2,1-2H3