tert-butyl 2-[2-oxidanylidene-4-(2-phenylethynyl)pyridin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[2-oxidanylidene-4-(2-phenylethynyl)pyridin-1-yl]ethanoate Openeye Name: tert-butyl 2-[2-oxo-4-(2-phenylethynyl)-1-pyridyl]acetate CAS Name: 2-[2-oxo-4-(2-phenylethynyl)-1-pyridinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-oxo-4-(2-phenylethynyl)pyridin-1-yl]acetate Traditional Name: 2-[2-keto-4-(2-phenylethynyl)-1-pyridyl]acetic acid tert-butyl ester Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=CC(=CC1=O)C#CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=CC(=CC1=O)C#CC2=CC=CC=C2

InChI

InChI=1S/C19H19NO3/c1-19(2,3)23-18(22)14-20-12-11-16(13-17(20)21)10-9-15-7-5-4-6-8-15/h4-8,11-13H,14H2,1-3H3