1-[2,2-bis(fluoranyl)-7-methylsulfanyl-1,3-benzodioxol-4-yl]-3-cyclopropyl-propane-1,3-dione

Systemtic Name: 1-[2,2-bis(fluoranyl)-7-methylsulfanyl-1,3-benzodioxol-4-yl]-3-cyclopropyl-propane-1,3-dione Openeye Name: 1-cyclopropyl-3-(2,2-difluoro-7-methylsulfanyl-1,3-benzodioxol-4-yl)propane-1,3-dione CAS Name: 1-cyclopropyl-3-[2,2-difluoro-7-(methylthio)-1,3-benzodioxol-4-yl]propane-1,3-dione IUPAC Name: 1-cyclopropyl-3-(2,2-difluoro-7-methylsulfanyl-1,3-benzodioxol-4-yl)propane-1,3-dione Traditional Name: 1-cyclopropyl-3-[2,2-difluoro-7-(methylthio)-1,3-benzodioxol-4-yl]propane-1,3-dione Formula: C14H12F2O4S MolecularWeight: 314.304486

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(=C(C=C1)C(=O)CC(=O)C3CC3)OC(O2)(F)F

Isomeric SMILES

CSC1=C2C(=C(C=C1)C(=O)CC(=O)C3CC3)OC(O2)(F)F

InChI

InChI=1S/C14H12F2O4S/c1-21-11-5-4-8(10(18)6-9(17)7-2-3-7)12-13(11)20-14(15,16)19-12/h4-5,7H,2-3,6H2,1H3