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Molecule : QSH

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C7H4Br2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)
2	InChIKey	InChI	1.03	PHWAJJWKNLWZGJ-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	OC(=O)c1cc(Br)c(O)c(Br)c1
4	SMILES	OpenEye OEToolkits	2.0.7	c1c(cc(c(c1Br)O)Br)C(=O)O
5	Canonical SMILES	CACTVS	3.385	OC(=O)c1cc(Br)c(O)c(Br)c1
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	c1c(cc(c(c1Br)O)Br)C(=O)O