2-[2,2-bis(chloranyl)-1,3-benzodioxol-5-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[2,2-bis(chloranyl)-1,3-benzodioxol-5-yl]-3-methyl-butanoic acid Openeye Name: 2-(2,2-dichloro-1,3-benzodioxol-5-yl)-3-methyl-butanoic acid CAS Name: 2-(2,2-dichloro-1,3-benzodioxol-5-yl)-3-methylbutanoic acid IUPAC Name: 2-(2,2-dichloro-1,3-benzodioxol-5-yl)-3-methylbutanoic acid Traditional Name: 2-(2,2-dichloro-1,3-benzodioxol-5-yl)-3-methyl-butyric acid Formula: C12H12Cl2O4 MolecularWeight: 291.12728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OC(O2)(Cl)Cl)C(=O)O

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OC(O2)(Cl)Cl)C(=O)O

InChI

InChI=1S/C12H12Cl2O4/c1-6(2)10(11(15)16)7-3-4-8-9(5-7)18-12(13,14)17-8/h3-6,10H,1-2H3,(H,15,16)