2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid

Systemtic Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid Openeye Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid CAS Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-6-sulfonic acid IUPAC Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-sulfonic acid Traditional Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-6-sulfonic acid Formula: C10H6Cl6O5S MolecularWeight: 450.93464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)O)C(OC(O2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)O)C(OC(O2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

InChI

InChI=1S/C10H6Cl6O5S/c11-9(12,13)7-5-3-4(22(17,18)19)1-2-6(5)20-8(21-7)10(14,15)16/h1-3,7-8H,(H,17,18,19)