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

Systemtic Name: 2,5-bis(chloranyl)-3-(cyanomethylsulfonyl)benzoic acid Openeye Name: 2,5-dichloro-3-(cyanomethylsulfonyl)benzoic acid CAS Name: 2,5-dichloro-3-(cyanomethylsulfonyl)benzoic acid IUPAC Name: 2,5-dichloro-3-(cyanomethylsulfonyl)benzoic acid Traditional Name: 2,5-dichloro-3-(cyanomethylsulfonyl)benzoic acid Formula: C9H5Cl2NO4S MolecularWeight: 294.1113

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)CC#N)Cl)C(=O)O)Cl

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)CC#N)Cl)C(=O)O)Cl

InChI

InChI=1S/C9H5Cl2NO4S/c10-5-3-6(9(13)14)8(11)7(4-5)17(15,16)2-1-12/h3-4H,2H2,(H,13,14)