2,5-bis(chloranyl)-3-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid

Systemtic Name: 2,5-bis(chloranyl)-3-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid Openeye Name: 2,5-dichloro-3-[2-(cyclopropylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 2,5-dichloro-3-[2-(cyclopropylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 2,5-dichloro-3-[2-(cyclopropylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 2,5-dichloro-3-[2-(cyclopropylamino)-2-keto-ethyl]sulfonyl-benzoic acid Formula: C12H11Cl2NO5S MolecularWeight: 352.19044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CS(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)Cl

Isomeric SMILES

C1CC1NC(=O)CS(=O)(=O)C2=C(C(=CC(=C2)Cl)C(=O)O)Cl

InChI

InChI=1S/C12H11Cl2NO5S/c13-6-3-8(12(17)18)11(14)9(4-6)21(19,20)5-10(16)15-7-1-2-7/h3-4,7H,1-2,5H2,(H,15,16)(H,17,18)