4-chloranyl-5-chloranylsulfonyl-2-ethyl-benzoic acid

Systemtic Name: 4-chloranyl-5-chloranylsulfonyl-2-ethyl-benzoic acid Openeye Name: 4-chloro-5-chlorosulfonyl-2-ethyl-benzoic acid CAS Name: 4-chloro-5-chlorosulfonyl-2-ethylbenzoic acid IUPAC Name: 4-chloro-5-chlorosulfonyl-2-ethylbenzoic acid Traditional Name: 4-chloro-5-chlorosulfonyl-2-ethyl-benzoic acid Formula: C9H8Cl2O4S MolecularWeight: 283.12842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Cl

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Cl

InChI

InChI=1S/C9H8Cl2O4S/c1-2-5-3-7(10)8(16(11,14)15)4-6(5)9(12)13/h3-4H,2H2,1H3,(H,12,13)