diethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(2-methylsulfanylethyl)propanedioate

Systemtic Name: diethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(2-methylsulfanylethyl)propanedioate Openeye Name: diethyl 2-(1,3-dioxoisoindolin-2-yl)-2-(2-methylsulfanylethyl)propanedioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-2-[2-(methylthio)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,3-dioxoisoindol-2-yl)-2-(2-methylsulfanylethyl)propanedioate Traditional Name: 2-[2-(methylthio)ethyl]-2-phthalimido-malonic acid diethyl ester Formula: C18H21NO6S MolecularWeight: 379.42744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCOC(=O)C(CCSC)(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C18H21NO6S/c1-4-24-16(22)18(10-11-26-3,17(23)25-5-2)19-14(20)12-8-6-7-9-13(12)15(19)21/h6-9H,4-5,10-11H2,1-3H3