tert-butyl 3-(6-cyanopyridin-3-yl)propanoate

Systemtic Name: tert-butyl 3-(6-cyanopyridin-3-yl)propanoate Openeye Name: tert-butyl 3-(6-cyano-3-pyridyl)propanoate CAS Name: 3-(6-cyano-3-pyridinyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(6-cyanopyridin-3-yl)propanoate Traditional Name: 3-(6-cyano-3-pyridyl)propionic acid tert-butyl ester Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=CN=C(C=C1)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=CN=C(C=C1)C#N

InChI

InChI=1S/C13H16N2O2/c1-13(2,3)17-12(16)7-5-10-4-6-11(8-14)15-9-10/h4,6,9H,5,7H2,1-3H3