(3-decanoyloxy-2-hexadecanoyloxy-propyl) pyridine-3-carboxylate

Systemtic Name: (3-decanoyloxy-2-hexadecanoyloxy-propyl) pyridine-3-carboxylate Openeye Name: (3-decanoyloxy-2-hexadecanoyloxy-propyl) pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [3-(1-oxodecoxy)-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: (3-decanoyloxy-2-hexadecanoyloxypropyl) pyridine-3-carboxylate Traditional Name: nicotinic acid (3-capryloxy-2-hexadecanoyloxy-propyl) ester Formula: C35H59NO6 MolecularWeight: 589.84606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC)COC(=O)C1=CN=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC)COC(=O)C1=CN=CC=C1

InChI

InChI=1S/C35H59NO6/c1-3-5-7-9-11-12-13-14-15-16-18-20-22-26-34(38)42-32(30-41-35(39)31-24-23-27-36-28-31)29-40-33(37)25-21-19-17-10-8-6-4-2/h23-24,27-28,32H,3-22,25-26,29-30H2,1-2H3