dimethyl 5-[2-(2-oxidanylidenepropylsulfanyl)phenyl]carbonyloxybenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(2-oxidanylidenepropylsulfanyl)phenyl]carbonyloxybenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(2-acetonylsulfanylbenzoyl)oxybenzene-1,3-dicarboxylate CAS Name: 5-[oxo-[2-(2-oxopropylthio)phenyl]methoxy]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-(2-oxopropylsulfanyl)benzoyl]oxybenzene-1,3-dicarboxylate Traditional Name: 5-[2-(acetonylthio)benzoyl]oxybenzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H18O7S MolecularWeight: 402.41772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H18O7S/c1-12(21)11-28-17-7-5-4-6-16(17)20(24)27-15-9-13(18(22)25-2)8-14(10-15)19(23)26-3/h4-10H,11H2,1-3H3