RHW

4-(1-benzofuran-5-yl)pyridine-2,6-diamine

Created:	2020-09-30
Last modified:	2021-05-26

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1 entries where RHW is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	16

2D diagram of RHW

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Chemical Component Summary
Name	4-(1-benzofuran-5-yl)pyridine-2,6-diamine
Systematic Name (OpenEye OEToolkits)	4-(1-benzofuran-5-yl)pyridine-2,6-diamine
Formula	C₁₃ H₁₁ N₃ O
Molecular Weight	225.246
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Nc1cc(cc(N)n1)c2ccc3occc3c2
SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cco2)cc1c3cc(nc(c3)N)N
Canonical SMILES	CACTVS	3.385	Nc1cc(cc(N)n1)c2ccc3occc3c2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cco2)cc1c3cc(nc(c3)N)N
InChI	InChI	1.03	InChI=1S/C13H11N3O/c14-12-6-10(7-13(15)16-12)8-1-2-11-9(5-8)3-4-17-11/h1-7H,(H4,14,15,16)
InChIKey	InChI	1.03	GMWUNXLQEKAPBL-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	155920134

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