YIP

5-[(3-chloranylphenoxy)methyl]-1,2,4-triaza-3-azanidacyclopenta-1,4-diene

Created:	2015-11-15
Last modified:	2016-03-02

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1 entries where YIP is found as a standalone ligand

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Chemical Details
Formal Charge	-1
Atom Count	20
Chiral Atom Count	0
Bond Count	21
Aromatic Bond Count	11

2D diagram of YIP

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Chemical Component Summary
Name	5-[(3-chloranylphenoxy)methyl]-1,2,4-triaza-3-azanidacyclopenta-1,4-diene
Systematic Name (OpenEye OEToolkits)	5-[(3-chloranylphenoxy)methyl]-1,2,4-triaza-3-azanidacyclopenta-1,4-diene
Formula	C₈ H₆ Cl N₄ O
Molecular Weight	209.612
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Clc1cccc(OCc2n[n-]nn2)c1
SMILES	OpenEye OEToolkits	1.7.6	c1cc(cc(c1)Cl)OCc2n[n-]nn2
Canonical SMILES	CACTVS	3.385	Clc1cccc(OCc2n[n-]nn2)c1
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc(cc(c1)Cl)OCc2n[n-]nn2
InChI	InChI	1.03	InChI=1S/C8H6ClN4O/c9-6-2-1-3-7(4-6)14-5-8-10-12-13-11-8/h1-4H,5H2/q-1
InChIKey	InChI	1.03	YMQZGHUJRRCFAM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	137350192

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