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Molecule : WAE

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.06	InChI=1S/C9H13NO2S/c1-7-5-4-6-8(2)9(7)10-13(3,11)12/h4-6,10H,1-3H3
2	InChIKey	InChI	1.06	CLMPXVSJALKBTQ-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	O=S(C)(=O)Nc1c(C)cccc1C
4	SMILES	CACTVS	3.385	Cc1cccc(C)c1N[S](C)(=O)=O
5	SMILES	OpenEye OEToolkits	2.0.7	Cc1cccc(c1NS(=O)(=O)C)C
6	Canonical SMILES	CACTVS	3.385	Cc1cccc(C)c1N[S](C)(=O)=O
7	Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cccc(c1NS(=O)(=O)C)C