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Molecule : HJ7

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C7H6O7/c8-4(7(13)14)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,9,10)(H,11,12)(H,13,14)/b3-1-
2	InChIKey	InChI	1.03	POTZSFVTPSBXLW-IWQZZHSRSA-N
3	SMILES	ACDLabs	12.01	C(\C=C(\CC(O)=O)C(O)=O)(=O)C(O)=O
4	SMILES	CACTVS	3.385	OC(=O)CC(=CC(=O)C(O)=O)C(O)=O
5	SMILES	OpenEye OEToolkits	2.0.6	C(C(=CC(=O)C(=O)O)C(=O)O)C(=O)O
6	Canonical SMILES	CACTVS	3.385	OC(=O)CC(=C/C(=O)C(O)=O)/C(O)=O
7	Canonical SMILES	OpenEye OEToolkits	2.0.6	C(/C(=C/C(=O)C(=O)O)/C(=O)O)C(=O)O