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Molecule : MWN

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.06	InChI=1S/C10H8BrNO4/c1-16-10(15)6-3-4(11)2-5-7(6)12-9(14)8(5)13/h2-3,8,13H,1H3,(H,12,14)/t8-/m1/s1
2	InChIKey	InChI	1.06	CLECANRFNXEJLT-MRVPVSSYSA-N
3	SMILES	ACDLabs	12.01	O=C(OC)c1cc(Br)cc2c1NC(=O)C2O
4	SMILES	CACTVS	3.385	COC(=O)c1cc(Br)cc2[CH](O)C(=O)Nc12
5	SMILES	OpenEye OEToolkits	2.0.7	COC(=O)c1cc(cc2c1NC(=O)C2O)Br
6	Canonical SMILES	CACTVS	3.385	COC(=O)c1cc(Br)cc2[C@@H](O)C(=O)Nc12
7	Canonical SMILES	OpenEye OEToolkits	2.0.7	COC(=O)c1cc(cc2c1NC(=O)[C@@H]2O)Br