(6-propan-2-yl-1,3-benzodioxol-5-yl)methylsulfanyl ethanoate

Systemtic Name: (6-propan-2-yl-1,3-benzodioxol-5-yl)methylsulfanyl ethanoate Openeye Name: (6-isopropyl-1,3-benzodioxol-5-yl)methylsulfanyl acetate CAS Name: acetic acid [(6-propan-2-yl-1,3-benzodioxol-5-yl)methylthio] ester IUPAC Name: (6-propan-2-yl-1,3-benzodioxol-5-yl)methylsulfanyl acetate Traditional Name: acetic acid [(6-isopropyl-1,3-benzodioxol-5-yl)methylthio] ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1CSOC(=O)C)OCO2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1CSOC(=O)C)OCO2

InChI

InChI=1S/C13H16O4S/c1-8(2)11-5-13-12(15-7-16-13)4-10(11)6-18-17-9(3)14/h4-5,8H,6-7H2,1-3H3