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

Systemtic Name: (phenylmethyl) 2-methyl-1,1-bis(oxidanylidene)thiolane-2-carboxylate Openeye Name: benzyl 2-methyl-1,1-dioxo-thiolane-2-carboxylate CAS Name: 2-methyl-1,1-dioxo-2-thiolanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-1,1-dioxothiolane-2-carboxylate Traditional Name: 1,1-diketo-2-methyl-thiolane-2-carboxylic acid benzyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCS1(=O)=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1(CCCS1(=O)=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H16O4S/c1-13(8-5-9-18(13,15)16)12(14)17-10-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3