S-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: S-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C11H10O4S MolecularWeight: 238.2597

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=O)SCC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H10O4S/c1-7(12)16-5-9(13)8-2-3-10-11(4-8)15-6-14-10/h2-4H,5-6H2,1H3