sodium; 3-diphenylphosphanylbenzenesulfonate; tetrakis(bromanyl)methane

Systemtic Name: sodium; 3-diphenylphosphanylbenzenesulfonate; tetrakis(bromanyl)methane Openeye Name: sodium; carbon tetrabromide; 3-diphenylphosphanylbenzenesulfonate CAS Name: sodium; 3-diphenylphosphinobenzenesulfonate; tetrabromomethane IUPAC Name: sodium; 3-diphenylphosphanylbenzenesulfonate; tetrabromomethane Traditional Name: sodium; carbon tetrabromide; 3-diphenylphosphinobesylate Formula: C19H14Br4NaO3PS MolecularWeight: 695.957191

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)[O-].C(Br)(Br)(Br)Br.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)[O-].C(Br)(Br)(Br)Br.[Na+]

InChI

InChI=1S/C18H15O3PS.CBr4.Na/c19-23(20,21)18-13-7-12-17(14-18)22(15-8-3-1-4-9-15)16-10-5-2-6-11-16;2-1(3,4)5;/h1-14H,(H,19,20,21);;/q;;+1/p-1