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Molecule : MDO

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C8H11N3O3/c1-4(9)7-10-5(2)8(14)11(7)3-6(12)13/h4H,2-3,9H2,1H3,(H,12,13)/t4-/m0/s1
2	InChIKey	InChI	1.03	OVDQQXSNYCENRU-BYPYZUCNSA-N
3	SMILES	ACDLabs	12.01	O=C1C(\N=C(N1CC(=O)O)C(N)C)=C
4	SMILES	CACTVS	3.370	C[CH](N)C1=NC(=C)C(=O)N1CC(O)=O
5	SMILES	OpenEye OEToolkits	1.7.2	CC(C1=NC(=C)C(=O)N1CC(=O)O)N
6	Canonical SMILES	CACTVS	3.370	C[C@H](N)C1=NC(=C)C(=O)N1CC(O)=O
7	Canonical SMILES	OpenEye OEToolkits	1.7.2	C[C@@H](C1=NC(=C)C(=O)N1CC(=O)O)N