pyridin-2-ylmethyl 2-methylhexanoate

Systemtic Name: pyridin-2-ylmethyl 2-methylhexanoate Openeye Name: 2-pyridylmethyl 2-methylhexanoate CAS Name: 2-methylhexanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 2-methylhexanoate Traditional Name: 2-methylhexanoic acid 2-pyridylmethyl ester Formula: C13H19NO2 MolecularWeight: 221.29546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(=O)OCC1=CC=CC=N1

Isomeric SMILES

CCCCC(C)C(=O)OCC1=CC=CC=N1

InChI

InChI=1S/C13H19NO2/c1-3-4-7-11(2)13(15)16-10-12-8-5-6-9-14-12/h5-6,8-9,11H,3-4,7,10H2,1-2H3