tert-butyl 3-oxidanylidene-3-pyridin-3-yl-propanoate

Systemtic Name: tert-butyl 3-oxidanylidene-3-pyridin-3-yl-propanoate Openeye Name: tert-butyl 3-oxo-3-(3-pyridyl)propanoate CAS Name: 3-oxo-3-(3-pyridinyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-3-pyridin-3-ylpropanoate Traditional Name: 3-keto-3-(3-pyridyl)propionic acid tert-butyl ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)C1=CN=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)C1=CN=CC=C1

InChI

InChI=1S/C12H15NO3/c1-12(2,3)16-11(15)7-10(14)9-5-4-6-13-8-9/h4-6,8H,7H2,1-3H3