LLX

N-(4-aminobiphenyl-3-yl)benzamide

Created:	2010-04-06
Last modified:	2011-06-04

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1 entries where LLX is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	38
Chiral Atom Count	0
Bond Count	40
Aromatic Bond Count	19

2D diagram of LLX

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Chemical Component Summary
Name	N-(4-aminobiphenyl-3-yl)benzamide
Systematic Name (OpenEye OEToolkits)	N-(2-azanyl-5-phenyl-phenyl)benzamide
Formula	C₁₉ H₁₆ N₂ O
Molecular Weight	288.343
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(Nc1cc(ccc1N)c2ccccc2)c3ccccc3
SMILES	CACTVS	3.370	Nc1ccc(cc1NC(=O)c2ccccc2)c3ccccc3
SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)c2ccc(c(c2)NC(=O)c3ccccc3)N
Canonical SMILES	CACTVS	3.370	Nc1ccc(cc1NC(=O)c2ccccc2)c3ccccc3
Canonical SMILES	OpenEye OEToolkits	1.7.0	c1ccc(cc1)c2ccc(c(c2)NC(=O)c3ccccc3)N
InChI	InChI	1.03	InChI=1S/C19H16N2O/c20-17-12-11-16(14-7-3-1-4-8-14)13-18(17)21-19(22)15-9-5-2-6-10-15/h1-13H,20H2,(H,21,22)
InChIKey	InChI	1.03	ZWLFHHHQRUYIBT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL271741
PubChem	44454143
ChEMBL	CHEMBL271741

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