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Molecule : WCI

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.06	InChI=1S/C11H9Cl2N3O/c12-9-3-2-8(6-10(9)13)15-11(17)7-16-5-1-4-14-16/h1-6H,7H2,(H,15,17)
2	InChIKey	InChI	1.06	OJNBQDXTZKXOOH-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	O=C(Nc1ccc(Cl)c(Cl)c1)Cn1cccn1
4	SMILES	CACTVS	3.385	Clc1ccc(NC(=O)Cn2cccn2)cc1Cl
5	SMILES	OpenEye OEToolkits	2.0.7	c1cnn(c1)CC(=O)Nc2ccc(c(c2)Cl)Cl
6	Canonical SMILES	CACTVS	3.385	Clc1ccc(NC(=O)Cn2cccn2)cc1Cl
7	Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cnn(c1)CC(=O)Nc2ccc(c(c2)Cl)Cl