tert-butyl 2-[3-ethoxy-2,2-bis(fluoranyl)-1-oxidanyl-3-oxidanylidene-propyl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-[3-ethoxy-2,2-bis(fluoranyl)-1-oxidanyl-3-oxidanylidene-propyl]pyrrole-1-carboxylate Openeye Name: tert-butyl 2-(3-ethoxy-2,2-difluoro-1-hydroxy-3-oxo-propyl)pyrrole-1-carboxylate CAS Name: 2-(3-ethoxy-2,2-difluoro-1-hydroxy-3-oxopropyl)-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-ethoxy-2,2-difluoro-1-hydroxy-3-oxopropyl)pyrrole-1-carboxylate Traditional Name: 2-(3-ethoxy-2,2-difluoro-1-hydroxy-3-keto-propyl)pyrrole-1-carboxylic acid tert-butyl ester Formula: C14H19F2NO5 MolecularWeight: 319.301166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CN1C(=O)OC(C)(C)C)O)(F)F

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CN1C(=O)OC(C)(C)C)O)(F)F

InChI

InChI=1S/C14H19F2NO5/c1-5-21-11(19)14(15,16)10(18)9-7-6-8-17(9)12(20)22-13(2,3)4/h6-8,10,18H,5H2,1-4H3