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Molecule : 4MP

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C12H13NO3/c1-16-10-6-4-9(5-7-10)12(15)13-8-2-3-11(13)14/h4-7H,2-3,8H2,1H3
2	InChIKey	InChI	1.03	ZXNRTKGTQJPIJK-UHFFFAOYSA-N
3	SMILES	ACDLabs	10.04	O=C2N(C(=O)c1ccc(OC)cc1)CCC2
4	SMILES	CACTVS	3.341	COc1ccc(cc1)C(=O)N2CCCC2=O
5	SMILES	OpenEye OEToolkits	1.5.0	COc1ccc(cc1)C(=O)N2CCCC2=O
6	Canonical SMILES	CACTVS	3.341	COc1ccc(cc1)C(=O)N2CCCC2=O
7	Canonical SMILES	OpenEye OEToolkits	1.5.0	COc1ccc(cc1)C(=O)N2CCCC2=O