(2,3,6-trimethylphenyl) 1,1-bis(oxidanylidene)thiolane-3-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) 1,1-bis(oxidanylidene)thiolane-3-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 1,1-dioxothiolane-3-carboxylate CAS Name: 1,1-dioxo-3-thiolanecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 1,1-dioxothiolane-3-carboxylate Traditional Name: 1,1-diketothiolane-3-carboxylic acid (2,3,6-trimethylphenyl) ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2CCS(=O)(=O)C2)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2CCS(=O)(=O)C2)C

InChI

InChI=1S/C14H18O4S/c1-9-4-5-10(2)13(11(9)3)18-14(15)12-6-7-19(16,17)8-12/h4-5,12H,6-8H2,1-3H3