(phenylmethyl) 4-methyl-1,2-dithiolane-4-carboxylate

Systemtic Name: (phenylmethyl) 4-methyl-1,2-dithiolane-4-carboxylate Openeye Name: benzyl 4-methyldithiolane-4-carboxylate CAS Name: 4-methyl-4-dithiolanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyldithiolane-4-carboxylate Traditional Name: 4-methyldithiolane-4-carboxylic acid benzyl ester Formula: C12H14O2S2 MolecularWeight: 254.36836

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSSC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1(CSSC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C12H14O2S2/c1-12(8-15-16-9-12)11(13)14-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3