[1-oxidanylidene-3-[2-(2-oxidanylideneethyl)-1,3-dithiolan-2-yl]propan-2-yl] benzoate

Systemtic Name: [1-oxidanylidene-3-[2-(2-oxidanylideneethyl)-1,3-dithiolan-2-yl]propan-2-yl] benzoate Openeye Name: [1-formyl-2-[2-(2-oxoethyl)-1,3-dithiolan-2-yl]ethyl] benzoate CAS Name: benzoic acid [1-oxo-3-[2-(2-oxoethyl)-1,3-dithiolan-2-yl]propan-2-yl] ester IUPAC Name: [1-oxo-3-[2-(2-oxoethyl)-1,3-dithiolan-2-yl]propan-2-yl] benzoate Traditional Name: benzoic acid [1-formyl-2-[2-(2-ketoethyl)-1,3-dithiolan-2-yl]ethyl] ester Formula: C15H16O4S2 MolecularWeight: 324.41514

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)(CC=O)CC(C=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CSC(S1)(CC=O)CC(C=O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H16O4S2/c16-7-6-15(20-8-9-21-15)10-13(11-17)19-14(18)12-4-2-1-3-5-12/h1-5,7,11,13H,6,8-10H2