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Molecule : 0WS

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C9H7N3O2/c13-9(14)6-1-3-10-8(5-6)7-2-4-11-12-7/h1-5H,(H,11,12)(H,13,14)
2	InChIKey	InChI	1.03	NTNYOLXCVCDWFY-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	O=C(O)c2ccnc(c1nncc1)c2
4	SMILES	CACTVS	3.370	OC(=O)c1ccnc(c1)c2cc[nH]n2
5	SMILES	OpenEye OEToolkits	1.7.6	c1c[nH]nc1c2cc(ccn2)C(=O)O
6	Canonical SMILES	CACTVS	3.370	OC(=O)c1ccnc(c1)c2cc[nH]n2
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	c1c[nH]nc1c2cc(ccn2)C(=O)O