ethyl 2-(1,3-benzodioxol-5-ylmethylsulfanyl)ethanoate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylmethylsulfanyl)ethanoate Openeye Name: ethyl 2-(1,3-benzodioxol-5-ylmethylsulfanyl)acetate CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-ylmethylsulfanyl)acetate Traditional Name: 2-(piperonylthio)acetic acid ethyl ester Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOC(=O)CSCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H14O4S/c1-2-14-12(13)7-17-6-9-3-4-10-11(5-9)16-8-15-10/h3-5H,2,6-8H2,1H3