pyridin-3-ylmethyl 14-methylhexadecanoate

Systemtic Name: pyridin-3-ylmethyl 14-methylhexadecanoate Openeye Name: 3-pyridylmethyl 14-methylhexadecanoate CAS Name: 14-methylhexadecanoic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl 14-methylhexadecanoate Traditional Name: 14-methylpalmitic acid 3-pyridylmethyl ester Formula: C23H39NO2 MolecularWeight: 361.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCCCCCCCCCC(=O)OCC1=CN=CC=C1

Isomeric SMILES

CCC(C)CCCCCCCCCCCCC(=O)OCC1=CN=CC=C1

InChI

InChI=1S/C23H39NO2/c1-3-21(2)15-12-10-8-6-4-5-7-9-11-13-17-23(25)26-20-22-16-14-18-24-19-22/h14,16,18-19,21H,3-13,15,17,20H2,1-2H3