(3,3-dimethyl-2-oxidanylidene-butyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-phthalimido-butyric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C(CCSC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C(CCSC)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C19H23NO5S/c1-19(2,3)15(21)11-25-18(24)14(9-10-26-4)20-16(22)12-7-5-6-8-13(12)17(20)23/h5-8,14H,9-11H2,1-4H3