(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C16H14O3S3 MolecularWeight: 350.47556

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C16H14O3S3/c17-13(14-2-1-7-20-14)10-19-15(18)11-3-5-12(6-4-11)16-21-8-9-22-16/h1-7,16H,8-10H2