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Molecule : 723

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C17H12ClNO3/c18-11-6-7-14-12(8-11)16(10-4-2-1-3-5-10)13(9-15(20)21)17(22)19-14/h1-8H,9H2,(H,19,22)(H,20,21)
2	InChIKey	InChI	1.03	SHDUUQWYFNJIAG-UHFFFAOYSA-N
3	SMILES	CACTVS	3.352	OC(=O)CC1=C(c2ccccc2)c3cc(Cl)ccc3NC1=O
4	SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)C2=C(C(=O)Nc3c2cc(cc3)Cl)CC(=O)O
5	Canonical SMILES	CACTVS	3.352	OC(=O)CC1=C(c2ccccc2)c3cc(Cl)ccc3NC1=O
6	Canonical SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)C2=C(C(=O)Nc3c2cc(cc3)Cl)CC(=O)O