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Molecule : 6DN

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C8H16N2O4/c9-6(8(13)14)3-1-2-4-10-5-7(11)12/h6,10H,1-5,9H2,(H,11,12)(H,13,14)/t6-/m0/s1
2	InChIKey	InChI	1.03	NUXSIDPKKIEIMI-LURJTMIESA-N
3	SMILES	CACTVS	3.385	N[CH](CCCCNCC(O)=O)C(O)=O
4	SMILES	OpenEye OEToolkits	2.0.5	C(CCNCC(=O)O)CC(C(=O)O)N
5	Canonical SMILES	CACTVS	3.385	N[C@@H](CCCCNCC(O)=O)C(O)=O
6	Canonical SMILES	OpenEye OEToolkits	2.0.5	C(CCNCC(=O)O)C[C@@H](C(=O)O)N