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Molecule : W8A

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C8H12N2O4S/c1-5(15-4-6(11)12)7(13)10-3-2-9-8(10)14/h5H,2-4H2,1H3,(H,9,14)(H,11,12)/t5-/m0/s1
2	InChIKey	InChI	1.03	VUVWCZPJVQECKW-YFKPBYRVSA-N
3	SMILES	ACDLabs	12.01	CC(C(N1CCNC1=O)=O)SCC(=O)O
4	SMILES	CACTVS	3.385	C[CH](SCC(O)=O)C(=O)N1CCNC1=O
5	SMILES	OpenEye OEToolkits	2.0.7	CC(C(=O)N1CCNC1=O)SCC(=O)O
6	Canonical SMILES	CACTVS	3.385	C[C@H](SCC(O)=O)C(=O)N1CCNC1=O
7	Canonical SMILES	OpenEye OEToolkits	2.0.7	C[C@@H](C(=O)N1CCNC1=O)SCC(=O)O