2,4-bis(chloranyl)-5-(2-imidazol-1-ylethylsulfonyl)benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-(2-imidazol-1-ylethylsulfonyl)benzoic acid Openeye Name: 2,4-dichloro-5-(2-imidazol-1-ylethylsulfonyl)benzoic acid CAS Name: 2,4-dichloro-5-[2-(1-imidazolyl)ethylsulfonyl]benzoic acid IUPAC Name: 2,4-dichloro-5-(2-imidazol-1-ylethylsulfonyl)benzoic acid Traditional Name: 2,4-dichloro-5-(2-imidazol-1-ylethylsulfonyl)benzoic acid Formula: C12H10Cl2N2O4S MolecularWeight: 349.1898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CN(C=N1)CCS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C12H10Cl2N2O4S/c13-9-6-10(14)11(5-8(9)12(17)18)21(19,20)4-3-16-2-1-15-7-16/h1-2,5-7H,3-4H2,(H,17,18)