tert-butyl 2-[1,3-bis(oxidanylidene)isoindol-4-yl]oxy-2-methylsulfanyl-ethanoate

Systemtic Name: tert-butyl 2-[1,3-bis(oxidanylidene)isoindol-4-yl]oxy-2-methylsulfanyl-ethanoate Openeye Name: tert-butyl 2-(1,3-dioxoisoindolin-4-yl)oxy-2-methylsulfanyl-acetate CAS Name: 2-[(1,3-dioxo-4-isoindolyl)oxy]-2-(methylthio)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(1,3-dioxoisoindol-4-yl)oxy-2-methylsulfanylacetate Traditional Name: 2-(1,3-diketoisoindolin-4-yl)oxy-2-(methylthio)acetic acid tert-butyl ester Formula: C15H17NO5S MolecularWeight: 323.36418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(OC1=CC=CC2=C1C(=O)NC2=O)SC

Isomeric SMILES

CC(C)(C)OC(=O)C(OC1=CC=CC2=C1C(=O)NC2=O)SC

InChI

InChI=1S/C15H17NO5S/c1-15(2,3)21-13(19)14(22-4)20-9-7-5-6-8-10(9)12(18)16-11(8)17/h5-7,14H,1-4H3,(H,16,17,18)