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

Systemtic Name: tert-butyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-2-phenylsulfanyl-ethanoate Openeye Name: tert-butyl 2-(1,3-dioxoisoindolin-2-yl)oxy-2-phenylsulfanyl-acetate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)oxy]-2-(phenylthio)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(1,3-dioxoisoindol-2-yl)oxy-2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)-2-phthalimidooxy-acetic acid tert-butyl ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(ON1C(=O)C2=CC=CC=C2C1=O)SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C(ON1C(=O)C2=CC=CC=C2C1=O)SC3=CC=CC=C3

InChI

InChI=1S/C20H19NO5S/c1-20(2,3)25-18(24)19(27-13-9-5-4-6-10-13)26-21-16(22)14-11-7-8-12-15(14)17(21)23/h4-12,19H,1-3H3