O3-tert-butyl O1-ethyl 2-(2-tert-butylsulfanyl-4-oxidanylidene-azetidin-1-yl)propanedioate

Systemtic Name: O3-tert-butyl O1-ethyl 2-(2-tert-butylsulfanyl-4-oxidanylidene-azetidin-1-yl)propanedioate Openeye Name: O1-tert-butyl O3-ethyl 2-(2-tert-butylsulfanyl-4-oxo-azetidin-1-yl)propanedioate CAS Name: 2-[2-(tert-butylthio)-4-oxo-1-azetidinyl]propanedioic acid O3-tert-butyl ester O1-ethyl ester IUPAC Name: 3-O-tert-butyl 1-O-ethyl 2-(2-tert-butylsulfanyl-4-oxoazetidin-1-yl)propanedioate Traditional Name: 2-[2-(tert-butylthio)-4-keto-azetidin-1-yl]malonic acid O1-tert-butyl ester O3-ethyl ester Formula: C16H27NO5S MolecularWeight: 345.45428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OC(C)(C)C)N1C(CC1=O)SC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C(=O)OC(C)(C)C)N1C(CC1=O)SC(C)(C)C

InChI

InChI=1S/C16H27NO5S/c1-8-21-13(19)12(14(20)22-15(2,3)4)17-10(18)9-11(17)23-16(5,6)7/h11-12H,8-9H2,1-7H3