[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-methylsulfanyl-propyl] ethanoate

Systemtic Name: [3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-methylsulfanyl-propyl] ethanoate Openeye Name: [3-(1,3-dioxoisoindolin-2-yl)-1-methylsulfanyl-propyl] acetate CAS Name: acetic acid [3-(1,3-dioxo-2-isoindolyl)-1-(methylthio)propyl] ester IUPAC Name: [3-(1,3-dioxoisoindol-2-yl)-1-methylsulfanylpropyl] acetate Traditional Name: acetic acid [1-(methylthio)-3-phthalimido-propyl] ester Formula: C14H15NO4S MolecularWeight: 293.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCN1C(=O)C2=CC=CC=C2C1=O)SC

Isomeric SMILES

CC(=O)OC(CCN1C(=O)C2=CC=CC=C2C1=O)SC

InChI

InChI=1S/C14H15NO4S/c1-9(16)19-12(20-2)7-8-15-13(17)10-5-3-4-6-11(10)14(15)18/h3-6,12H,7-8H2,1-2H3