2-[[3-[tris(bromanyl)methylsulfonyl]phenyl]carbonylamino]ethanesulfonic acid

Systemtic Name: 2-[[3-[tris(bromanyl)methylsulfonyl]phenyl]carbonylamino]ethanesulfonic acid Openeye Name: 2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethanesulfonic acid CAS Name: 2-[[oxo-[3-(tribromomethylsulfonyl)phenyl]methyl]amino]ethanesulfonic acid IUPAC Name: 2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethanesulfonic acid Traditional Name: 2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethanesulfonic acid Formula: C10H10Br3NO6S2 MolecularWeight: 544.0315

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)C(Br)(Br)Br)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)C(Br)(Br)Br)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C10H10Br3NO6S2/c11-10(12,13)22(19,20)8-3-1-2-7(6-8)9(15)14-4-5-21(16,17)18/h1-3,6H,4-5H2,(H,14,15)(H,16,17,18)