(phenylmethyl) 1,1-bis(oxidanylidene)thiolane-2-carboxylate

Systemtic Name: (phenylmethyl) 1,1-bis(oxidanylidene)thiolane-2-carboxylate Openeye Name: benzyl 1,1-dioxothiolane-2-carboxylate CAS Name: 1,1-dioxo-2-thiolanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,1-dioxothiolane-2-carboxylate Traditional Name: 1,1-diketothiolane-2-carboxylic acid benzyl ester Formula: C12H14O4S MolecularWeight: 254.30216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(S(=O)(=O)C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(S(=O)(=O)C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C12H14O4S/c13-12(11-7-4-8-17(11,14)15)16-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2