tert-butyl [4-chloranyl-2-(3-oxidanylprop-1-ynyl)pyridin-3-yl] carbonate

Systemtic Name: tert-butyl [4-chloranyl-2-(3-oxidanylprop-1-ynyl)pyridin-3-yl] carbonate Openeye Name: tert-butyl [4-chloro-2-(3-hydroxyprop-1-ynyl)-3-pyridyl] carbonate CAS Name: carbonic acid tert-butyl [4-chloro-2-(3-hydroxyprop-1-ynyl)-3-pyridinyl] ester IUPAC Name: tert-butyl [4-chloro-2-(3-hydroxyprop-1-ynyl)pyridin-3-yl] carbonate Traditional Name: carbonic acid tert-butyl [4-chloro-2-(3-hydroxyprop-1-ynyl)-3-pyridyl] ester Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=C(C=CN=C1C#CCO)Cl

Isomeric SMILES

CC(C)(C)OC(=O)OC1=C(C=CN=C1C#CCO)Cl

InChI

InChI=1S/C13H14ClNO4/c1-13(2,3)19-12(17)18-11-9(14)6-7-15-10(11)5-4-8-16/h6-7,16H,8H2,1-3H3