methyl 2-[5-(cyanomethyl)-6-ethyl-pyridin-3-yl]ethanoate

Systemtic Name: methyl 2-[5-(cyanomethyl)-6-ethyl-pyridin-3-yl]ethanoate Openeye Name: methyl 2-[5-(cyanomethyl)-6-ethyl-3-pyridyl]acetate CAS Name: 2-[5-(cyanomethyl)-6-ethyl-3-pyridinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(cyanomethyl)-6-ethylpyridin-3-yl]acetate Traditional Name: 2-[5-(cyanomethyl)-6-ethyl-3-pyridyl]acetic acid methyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=N1)CC(=O)OC)CC#N

Isomeric SMILES

CCC1=C(C=C(C=N1)CC(=O)OC)CC#N

InChI

InChI=1S/C12H14N2O2/c1-3-11-10(4-5-13)6-9(8-14-11)7-12(15)16-2/h6,8H,3-4,7H2,1-2H3