8NY

5-iodanyl-1H-indazole

Created:	2015-03-06
Last modified:	2015-05-13

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1 entries where 8NY is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	0
Bond Count	16
Aromatic Bond Count	10

2D diagram of 8NY

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Chemical Component Summary
Name	5-iodanyl-1H-indazole
Systematic Name (OpenEye OEToolkits)	5-iodanyl-1H-indazole
Formula	C₇ H₅ I N₂
Molecular Weight	244.032
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Ic1ccc2[nH]ncc2c1
SMILES	OpenEye OEToolkits	1.7.6	c1cc2c(cc1I)cn[nH]2
Canonical SMILES	CACTVS	3.385	Ic1ccc2[nH]ncc2c1
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc2c(cc1I)cn[nH]2
InChI	InChI	1.03	InChI=1S/C7H5IN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
InChIKey	InChI	1.03	CGCHCLICSHIAAM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	21894739
ChEMBL	CHEMBL391348

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.