tert-butyl 2-(2-oxidanylidene-4-prop-2-ynoxy-azetidin-1-yl)-2-phenylsulfanyl-ethanoate

Systemtic Name: tert-butyl 2-(2-oxidanylidene-4-prop-2-ynoxy-azetidin-1-yl)-2-phenylsulfanyl-ethanoate Openeye Name: tert-butyl 2-(2-oxo-4-prop-2-ynoxy-azetidin-1-yl)-2-phenylsulfanyl-acetate CAS Name: 2-(2-oxo-4-prop-2-ynoxy-1-azetidinyl)-2-(phenylthio)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-oxo-4-prop-2-ynoxyazetidin-1-yl)-2-phenylsulfanylacetate Traditional Name: 2-(2-keto-4-propargyloxy-azetidin-1-yl)-2-(phenylthio)acetic acid tert-butyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(N1C(CC1=O)OCC#C)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C(N1C(CC1=O)OCC#C)SC2=CC=CC=C2

InChI

InChI=1S/C18H21NO4S/c1-5-11-22-15-12-14(20)19(15)16(17(21)23-18(2,3)4)24-13-9-7-6-8-10-13/h1,6-10,15-16H,11-12H2,2-4H3