3-butylsulfonyl-2,5-bis(chloranyl)benzoic acid

Systemtic Name: 3-butylsulfonyl-2,5-bis(chloranyl)benzoic acid Openeye Name: 3-butylsulfonyl-2,5-dichloro-benzoic acid CAS Name: 3-butylsulfonyl-2,5-dichlorobenzoic acid IUPAC Name: 3-butylsulfonyl-2,5-dichlorobenzoic acid Traditional Name: 3-butylsulfonyl-2,5-dichloro-benzoic acid Formula: C11H12Cl2O4S MolecularWeight: 311.18158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)Cl

Isomeric SMILES

CCCCS(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)Cl

InChI

InChI=1S/C11H12Cl2O4S/c1-2-3-4-18(16,17)9-6-7(12)5-8(10(9)13)11(14)15/h5-6H,2-4H2,1H3,(H,14,15)