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Molecule : XPC

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C5H10N2O2/c6-4-2-7-1-3(4)5(8)9/h3-4,7H,1-2,6H2,(H,8,9)/t3-,4-/m0/s1
2	InChIKey	InChI	1.03	RMNHPXDNGOBDOT-IMJSIDKUSA-N
3	SMILES	ACDLabs	12.01	O=C(O)C1CNCC1N
4	SMILES	CACTVS	3.370	N[CH]1CNC[CH]1C(O)=O
5	SMILES	OpenEye OEToolkits	1.7.0	C1C(C(CN1)N)C(=O)O
6	Canonical SMILES	CACTVS	3.370	N[C@H]1CNC[C@@H]1C(O)=O
7	Canonical SMILES	OpenEye OEToolkits	1.7.0	C1[C@@H]([C@H](CN1)N)C(=O)O