5-[2,4-bis(fluoranyl)phenyl]sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid

Systemtic Name: 5-[2,4-bis(fluoranyl)phenyl]sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid Openeye Name: 5-(2,4-difluorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid CAS Name: 5-(2,4-difluorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 5-(2,4-difluorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid Traditional Name: 5-(2,4-difluorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid Formula: C15H10F2O6S MolecularWeight: 356.298106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)C3=C(C=C(C=C3)F)F)OC(O2)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)C3=C(C=C(C=C3)F)F)OC(O2)C(=O)O

InChI

InChI=1S/C15H10F2O6S/c1-7-4-10-11(23-15(22-10)14(18)19)6-13(7)24(20,21)12-3-2-8(16)5-9(12)17/h2-6,15H,1H3,(H,18,19)