3,5-bis(chloranyl)-4-ethyl-benzenesulfonic acid

Systemtic Name: 3,5-bis(chloranyl)-4-ethyl-benzenesulfonic acid Openeye Name: 3,5-dichloro-4-ethyl-benzenesulfonic acid CAS Name: 3,5-dichloro-4-ethylbenzenesulfonic acid IUPAC Name: 3,5-dichloro-4-ethylbenzenesulfonic acid Traditional Name: 3,5-dichloro-4-ethyl-besylic acid Formula: C8H8Cl2O3S MolecularWeight: 255.11832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1Cl)S(=O)(=O)O)Cl

Isomeric SMILES

CCC1=C(C=C(C=C1Cl)S(=O)(=O)O)Cl

InChI

InChI=1S/C8H8Cl2O3S/c1-2-6-7(9)3-5(4-8(6)10)14(11,12)13/h3-4H,2H2,1H3,(H,11,12,13)