(phenylmethyl) 3-oxidanylidenebutanedithioate

Systemtic Name: (phenylmethyl) 3-oxidanylidenebutanedithioate Openeye Name: benzyl 3-oxobutanedithioate CAS Name: 3-oxobutanedithioic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxobutanedithioate Traditional Name: 3-ketobutanedithioic acid benzyl ester Formula: C11H12OS2 MolecularWeight: 224.34238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=S)SCC1=CC=CC=C1

Isomeric SMILES

CC(=O)CC(=S)SCC1=CC=CC=C1

InChI

InChI=1S/C11H12OS2/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3