methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfinyl-2-oxidanylidene-propanoate

Systemtic Name: methyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfinyl-2-oxidanylidene-propanoate Openeye Name: methyl 3-(1,3-dioxoisoindolin-2-yl)sulfinyl-2-oxo-propanoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)sulfinyl]-2-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(1,3-dioxoisoindol-2-yl)sulfinyl-2-oxopropanoate Traditional Name: 2-keto-3-phthalimidosulfinyl-propionic acid methyl ester Formula: C12H9NO6S MolecularWeight: 295.26796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO6S/c1-19-12(17)9(14)6-20(18)13-10(15)7-4-2-3-5-8(7)11(13)16/h2-5H,6H2,1H3