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sodium 2-(3-bromanylpropanoyloxy)benzenesulfonate

sodium 2-(3-bromanylpropanoyloxy)benzenesulfonate

Systemtic Name:sodium 2-(3-bromanylpropanoyloxy)benzenesulfonate
Openeye Name:sodium 2-(3-bromopropanoyloxy)benzenesulfonate
CAS Name:sodium 2-(3-bromo-1-oxopropoxy)benzenesulfonate
IUPAC Name:sodium 2-(3-bromopropanoyloxy)benzenesulfonate
Traditional Name:sodium 2-(3-bromopropanoyloxy)besylate
Formula: C9H8BrNaO5S
MolecularWeight: 331.11559
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC(=O)CCBr)S(=O)(=O)[O-].[Na+]


Isomeric SMILES

C1=CC=C(C(=C1)OC(=O)CCBr)S(=O)(=O)[O-].[Na+]


InChI

InChI=1S/C9H9BrO5S.Na/c10-6-5-9(11)15-7-3-1-2-4-8(7)16(12,13)14;/h1-4H,5-6H2,(H,12,13,14);/q;+1/p-1


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