sodium 2,3,5-tris(chloranyl)-4-ethyl-benzenesulfonate

Systemtic Name: sodium 2,3,5-tris(chloranyl)-4-ethyl-benzenesulfonate Openeye Name: sodium 2,3,5-trichloro-4-ethyl-benzenesulfonate CAS Name: sodium 2,3,5-trichloro-4-ethylbenzenesulfonate IUPAC Name: sodium 2,3,5-trichloro-4-ethylbenzenesulfonate Traditional Name: sodium 2,3,5-trichloro-4-ethyl-besylate Formula: C8H6Cl3NaO3S MolecularWeight: 311.54521

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1Cl)Cl)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

CCC1=C(C=C(C(=C1Cl)Cl)S(=O)(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C8H7Cl3O3S.Na/c1-2-4-5(9)3-6(15(12,13)14)8(11)7(4)10;/h3H,2H2,1H3,(H,12,13,14);/q;+1/p-1