sodium 3-[4-[tris(bromanyl)methylsulfonyl]phenyl]sulfonylbenzenesulfonate

Systemtic Name: sodium 3-[4-[tris(bromanyl)methylsulfonyl]phenyl]sulfonylbenzenesulfonate Openeye Name: sodium 3-[4-(tribromomethylsulfonyl)phenyl]sulfonylbenzenesulfonate CAS Name: sodium 3-[4-(tribromomethylsulfonyl)phenyl]sulfonylbenzenesulfonate IUPAC Name: sodium 3-[4-(tribromomethylsulfonyl)phenyl]sulfonylbenzenesulfonate Traditional Name: sodium 3-[4-(tribromomethylsulfonyl)phenyl]sulfonylbesylate Formula: C13H8Br3NaO7S3 MolecularWeight: 635.09519

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(Br)(Br)Br.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C(Br)(Br)Br.[Na+]

InChI

InChI=1S/C13H9Br3O7S3.Na/c14-13(15,16)25(19,20)10-6-4-9(5-7-10)24(17,18)11-2-1-3-12(8-11)26(21,22)23;/h1-8H,(H,21,22,23);/q;+1/p-1