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Molecule : 4BP

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C14H12Br2/c15-9-11-1-5-13(6-2-11)14-7-3-12(10-16)4-8-14/h1-8H,9-10H2
2	InChIKey	InChI	1.03	HMUGRILXVBKBID-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	BrCc2ccc(c1ccc(cc1)CBr)cc2
4	SMILES	CACTVS	3.370	BrCc1ccc(cc1)c2ccc(CBr)cc2
5	SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1CBr)c2ccc(cc2)CBr
6	Canonical SMILES	CACTVS	3.370	BrCc1ccc(cc1)c2ccc(CBr)cc2
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1CBr)c2ccc(cc2)CBr