5JW

{[(2,7-dichloro-9H-fluoren-9-ylidene)amino]oxy}acetic acid

Created:	2015-10-06
Last modified:	2016-03-23

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1 entries where 5JW is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	12

2D diagram of 5JW

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Chemical Component Summary
Name	{[(2,7-dichloro-9H-fluoren-9-ylidene)amino]oxy}acetic acid
Systematic Name (OpenEye OEToolkits)	2-[[2,7-bis(chloranyl)fluoren-9-ylidene]amino]oxyethanoic acid
Formula	C₁₅ H₉ Cl₂ N O₃
Molecular Weight	322.143
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Clc2ccc3c1ccc(cc1C(\c3c2)=N/OCC(O)=O)Cl
SMILES	CACTVS	3.385	OC(=O)CON=C1c2cc(Cl)ccc2c3ccc(Cl)cc13
SMILES	OpenEye OEToolkits	1.9.2	c1cc-2c(cc1Cl)C(=NOCC(=O)O)c3c2ccc(c3)Cl
Canonical SMILES	CACTVS	3.385	OC(=O)CON=C1c2cc(Cl)ccc2c3ccc(Cl)cc13
Canonical SMILES	OpenEye OEToolkits	1.9.2	c1cc-2c(cc1Cl)C(=NOCC(=O)O)c3c2ccc(c3)Cl
InChI	InChI	1.03	InChI=1S/C15H9Cl2NO3/c16-8-1-3-10-11-4-2-9(17)6-13(11)15(12(10)5-8)18-21-7-14(19)20/h1-6H,7H2,(H,19,20)
InChIKey	InChI	1.03	BZMUZKQLRPSKDP-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	137348363

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