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Molecule : OTQ

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C14H14N3O4S/c18-13-11-7-3-1-2-4-9(7)22-14(11)16-12(15-13)8-5-6-10(21-8)17(19)20/h5-6,12,16,19H,1-4H2,(H,15,18)/t12-/m0/s1
2	InChIKey	InChI	1.03	MOKSPNCNIWVHBB-LBPRGKRZSA-N
3	SMILES	CACTVS	3.385	[O-][N+](=O)c1oc(cc1)[CH]2NC(=O)c3c(N2)sc4CCCCc34
4	SMILES	OpenEye OEToolkits	3.1.0.0	c1cc(oc1C2Nc3c(c4c(s3)CCCC4)C(=O)N2)[N+](=O)[O-]
5	Canonical SMILES	CACTVS	3.385	[O-][N+](=O)c1oc(cc1)[C@H]2NC(=O)c3c(N2)sc4CCCCc34
6	Canonical SMILES	OpenEye OEToolkits	3.1.0.0	c1cc(oc1[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2)[N+](=O)[O-]