ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanyl-2-(3-oxidanylidenecyclohexen-1-yl)ethanoate

Systemtic Name: ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]sulfanyl-2-(3-oxidanylidenecyclohexen-1-yl)ethanoate Openeye Name: ethyl 2-(1,3-dioxoisoindolin-2-yl)sulfanyl-2-(3-oxocyclohexen-1-yl)acetate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)thio]-2-(3-oxo-1-cyclohexenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dioxoisoindol-2-yl)sulfanyl-2-(3-oxocyclohexen-1-yl)acetate Traditional Name: 2-(3-ketocyclohexen-1-yl)-2-(phthalimidothio)acetic acid ethyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=O)CCC1)SN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C(C1=CC(=O)CCC1)SN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H17NO5S/c1-2-24-18(23)15(11-6-5-7-12(20)10-11)25-19-16(21)13-8-3-4-9-14(13)17(19)22/h3-4,8-10,15H,2,5-7H2,1H3