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Molecule : BL2

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C11H21NO4/c1-7(2)6-8(9(13)14)12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t8-/m0/s1
2	InChIKey	InChI	1.03	MDXGYYOJGPFFJL-QMMMGPOBSA-N
3	SMILES	ACDLabs	12.01	O=C(OC(C)(C)C)NC(C(=O)O)CC(C)C
4	SMILES	CACTVS	3.370	CC(C)C[CH](NC(=O)OC(C)(C)C)C(O)=O
5	SMILES	OpenEye OEToolkits	1.7.6	CC(C)CC(C(=O)O)NC(=O)OC(C)(C)C
6	Canonical SMILES	CACTVS	3.370	CC(C)C[C@H](NC(=O)OC(C)(C)C)C(O)=O
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(C)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C