3,5,6-tris(chloranyl)-3-ethyl-cyclohexa-1,4-diene-1-sulfonic acid

Systemtic Name: 3,5,6-tris(chloranyl)-3-ethyl-cyclohexa-1,4-diene-1-sulfonic acid Openeye Name: 3,5,6-trichloro-3-ethyl-cyclohexa-1,4-diene-1-sulfonic acid CAS Name: 3,5,6-trichloro-3-ethyl-1-cyclohexa-1,4-dienesulfonic acid IUPAC Name: 3,5,6-trichloro-3-ethylcyclohexa-1,4-diene-1-sulfonic acid Traditional Name: 3,5,6-trichloro-3-ethyl-cyclohexa-1,4-diene-1-sulfonic acid Formula: C8H9Cl3O3S MolecularWeight: 291.57926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C(C(C(=C1)Cl)Cl)S(=O)(=O)O)Cl

Isomeric SMILES

CCC1(C=C(C(C(=C1)Cl)Cl)S(=O)(=O)O)Cl

InChI

InChI=1S/C8H9Cl3O3S/c1-2-8(11)3-5(9)7(10)6(4-8)15(12,13)14/h3-4,7H,2H2,1H3,(H,12,13,14)