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Molecule : JRQ

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C16H22N2O3/c1-3-21-15(19)10-14-16(20)17-8-9-18(14)11-13-6-4-12(2)5-7-13/h4-7,14H,3,8-11H2,1-2H3,(H,17,20)/t14-/m1/s1
2	InChIKey	InChI	1.03	DPGLMZMGVNDMDP-CQSZACIVSA-N
3	SMILES	CACTVS	3.385	CCOC(=O)C[CH]1N(CCNC1=O)Cc2ccc(C)cc2
4	SMILES	OpenEye OEToolkits	2.0.7	CCOC(=O)CC1C(=O)NCCN1Cc2ccc(cc2)C
5	Canonical SMILES	CACTVS	3.385	CCOC(=O)C[C@H]1N(CCNC1=O)Cc2ccc(C)cc2
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	CCOC(=O)C[C@@H]1C(=O)NCCN1Cc2ccc(cc2)C