2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid 2-phthalimidoethyl ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H17NO5S/c1-13(22)12-27-17-9-5-4-8-16(17)20(25)26-11-10-21-18(23)14-6-2-3-7-15(14)19(21)24/h2-9H,10-12H2,1H3