sodium (2-bromanylpyridin-3-yl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate

Systemtic Name: sodium (2-bromanylpyridin-3-yl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate Openeye Name: sodium (2-bromo-3-pyridyl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate CAS Name: sodium (2-bromo-3-pyridinyl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate IUPAC Name: sodium (2-bromopyridin-3-yl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate Traditional Name: sodium (2-bromo-3-pyridyl)oxy-[[(4-fluorophenyl)sulfonylamino]methyl]phosphinate Formula: C12H10BrFN2NaO5PS MolecularWeight: 447.149134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Br)OP(=O)(CNS(=O)(=O)C2=CC=C(C=C2)F)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(N=C1)Br)OP(=O)(CNS(=O)(=O)C2=CC=C(C=C2)F)[O-].[Na+]

InChI

InChI=1S/C12H11BrFN2O5PS.Na/c13-12-11(2-1-7-15-12)21-22(17,18)8-16-23(19,20)10-5-3-9(14)4-6-10;/h1-7,16H,8H2,(H,17,18);/q;+1/p-1