EHO

2-phenylazanylbenzoic acid

Created:	2019-12-24
Last modified:	2020-04-15

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3 entries where EHO is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	0
Bond Count	28
Aromatic Bond Count	12

2D diagram of EHO

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Chemical Component Summary
Name	2-phenylazanylbenzoic acid
Systematic Name (OpenEye OEToolkits)	2-phenylazanylbenzoic acid
Formula	C₁₃ H₁₁ N O₂
Molecular Weight	213.232
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1ccccc1Nc2ccccc2
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Nc2ccccc2C(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)c1ccccc1Nc2ccccc2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Nc2ccccc2C(=O)O
InChI	InChI	1.03	InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
InChIKey	InChI	1.03	ZWJINEZUASEZBH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL23832
PubChem	4386
ChEMBL	CHEMBL23832
ChEBI	CHEBI:34756
CCDC/CSD	PEFCAG, OYEBAX, PEFCAG01, QQQBTY02, QQQBTY01
COD	4512415, 7104491

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