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Molecule : 8QO

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C11H14N2O2/c1-7-6-12-11(13-7)9-4-3-8(15-2)5-10(9)14/h3-5,7,14H,6H2,1-2H3,(H,12,13)/t7-/m1/s1
2	InChIKey	InChI	1.03	GSHCIAWYWVRHMS-SSDOTTSWSA-N
3	SMILES	CACTVS	3.385	COc1ccc(c(O)c1)C2=NC[CH](C)N2
4	SMILES	OpenEye OEToolkits	2.0.6	CC1CN=C(N1)c2ccc(cc2O)OC
5	Canonical SMILES	CACTVS	3.385	COc1ccc(c(O)c1)C2=NC[C@@H](C)N2
6	Canonical SMILES	OpenEye OEToolkits	2.0.6	C[C@@H]1CN=C(N1)c2ccc(cc2O)OC