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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-methylsulfanyl-propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-methylsulfanyl-propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-2-(methylthio)-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-methylsulfanylpropan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-(methylthio)propan-1-one Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O3S/c1-7(15-2)11(12)8-3-4-9-10(5-8)14-6-13-9/h3-5,7H,6H2,1-2H3