H32

2-(3-fluoranyl-4-oxidanyl-phenyl)-3-oxidanylidene-1~{H}-isoindole-4-carboxylic acid

Created:	2016-07-29
Last modified:	2017-02-15

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1 entries where H32 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	33
Aromatic Bond Count	12

2D diagram of H32

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Chemical Component Summary
Name	2-(3-fluoranyl-4-oxidanyl-phenyl)-3-oxidanylidene-1~{H}-isoindole-4-carboxylic acid
Systematic Name (OpenEye OEToolkits)	2-(3-fluoranyl-4-oxidanyl-phenyl)-3-oxidanylidene-1~{H}-isoindole-4-carboxylic acid
Formula	C₁₅ H₁₀ F N O₄
Molecular Weight	287.243
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1cccc2CN(C(=O)c12)c3ccc(O)c(F)c3
SMILES	OpenEye OEToolkits	2.0.5	c1cc2c(c(c1)C(=O)O)C(=O)N(C2)c3ccc(c(c3)F)O
Canonical SMILES	CACTVS	3.385	OC(=O)c1cccc2CN(C(=O)c12)c3ccc(O)c(F)c3
Canonical SMILES	OpenEye OEToolkits	2.0.5	c1cc2c(c(c1)C(=O)O)C(=O)N(C2)c3ccc(c(c3)F)O
InChI	InChI	1.03	InChI=1S/C15H10FNO4/c16-11-6-9(4-5-12(11)18)17-7-8-2-1-3-10(15(20)21)13(8)14(17)19/h1-6,18H,7H2,(H,20,21)
InChIKey	InChI	1.03	KXNOWKVHICTJLR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	124081748

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