LLX

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

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

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Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count0
Bond Count40
Aromatic Bond Count19
2D diagram of LLX

Chemical Component Summary

NameN-(4-aminobiphenyl-3-yl)benzamide
Systematic Name (OpenEye OEToolkits)N-(2-azanyl-5-phenyl-phenyl)benzamide
FormulaC19 H16 N2 O
Molecular Weight288.343
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(Nc1cc(ccc1N)c2ccccc2)c3ccccc3
SMILESCACTVS3.370Nc1ccc(cc1NC(=O)c2ccccc2)c3ccccc3
SMILESOpenEye OEToolkits1.7.0c1ccc(cc1)c2ccc(c(c2)NC(=O)c3ccccc3)N
Canonical SMILESCACTVS3.370 Nc1ccc(cc1NC(=O)c2ccccc2)c3ccccc3
Canonical SMILESOpenEye OEToolkits1.7.0 c1ccc(cc1)c2ccc(c(c2)NC(=O)c3ccccc3)N
InChIInChI1.03 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)
InChIKeyInChI1.03 ZWLFHHHQRUYIBT-UHFFFAOYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL271741
PubChem 44454143
ChEMBL CHEMBL271741