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bromfenac sodium salt sesquihydrate

Properties

Image

Occurences in reactions

MNX_ID

MNXM103281

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₃₀H₂₈Br₂N₂Na₂O₉

charge

mass

763.99569

reference

InChIKey

PPOSVVJOVKVBPW-UHFFFAOYSA-L

InChI

InChI=1S/2C15H12BrNO3.2Na.3H2O/c2*16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19;;;;;/h2*1-7H,8,17H2,(H,18,19);;;3*1H2/q;;2*+1;;;/p-2

SMILES

Nc1c(CC(=O)[O-])cccc1C(=O)c1ccc(Br)cc1.Nc1c(CC(=O)[O-])cccc1C(=O)c1ccc(Br)cc1.O.O.O.[Na+].[Na+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:59176 chebi:59176	bromfenac sodium salt sesquihydrate bromfenac monosodium salt sesquihydrate bromfenac sodium bromfenac sodium hydrate sodium 2-amino-3-(4-bromobenzoyl) phenylacetate sesquihydrate sodium [2-amino-3-(4-bromobenzoyl)phenyl]acetate sesquihydrate sodium [2-amino-3-(4-bromobenzoyl)phenyl]acetate--water (2/3) sodium [2-amino-3-(p-bromobenzoyl)phenyl]acetate sesquihydrate
kegg.drug:D03163 keggD:D03163	Bromfenac sodium (USAN) Bromday (TN) Bromfenac sodium hydrate (JP18) Bromfenac sodium sesquihydrate Prolensa (TN) Xibrom (TN) Yellox (TN)
keggD:M_D03163	secondary/obsolete/fantasy identifier