2-[bis(bromanyl)methylsulfonyl]-5-(2-hydroxyethylcarbamoyl)benzoic acid

Systemtic Name: 2-[bis(bromanyl)methylsulfonyl]-5-(2-hydroxyethylcarbamoyl)benzoic acid Openeye Name: 2-(dibromomethylsulfonyl)-5-(2-hydroxyethylcarbamoyl)benzoic acid CAS Name: 2-(dibromomethylsulfonyl)-5-[(2-hydroxyethylamino)-oxomethyl]benzoic acid IUPAC Name: 2-(dibromomethylsulfonyl)-5-(2-hydroxyethylcarbamoyl)benzoic acid Traditional Name: 2-(dibromomethylsulfonyl)-5-(2-hydroxyethylcarbamoyl)benzoic acid Formula: C11H11Br2NO6S MolecularWeight: 445.08114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCO)C(=O)O)S(=O)(=O)C(Br)Br

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCO)C(=O)O)S(=O)(=O)C(Br)Br

InChI

InChI=1S/C11H11Br2NO6S/c12-11(13)21(19,20)8-2-1-6(5-7(8)10(17)18)9(16)14-3-4-15/h1-2,5,11,15H,3-4H2,(H,14,16)(H,17,18)