A1LU9

N-(4-acetamidophenyl)-5-ethanoyl-furan-2-carboxamide

Created: 2023-12-17
Last modified:  2024-12-04

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Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count36
Aromatic Bond Count11
2D diagram of A1LU9

Chemical Component Summary

NameN-(4-acetamidophenyl)-5-ethanoyl-furan-2-carboxamide
Systematic Name (OpenEye OEToolkits)~{N}-(4-acetamidophenyl)-5-ethanoyl-furan-2-carboxamide
FormulaC15 H14 N2 O4
Molecular Weight286.283
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CC(=O)Nc1ccc(NC(=O)c2oc(cc2)C(C)=O)cc1
SMILESOpenEye OEToolkits2.0.7CC(=O)c1ccc(o1)C(=O)Nc2ccc(cc2)NC(=O)C
Canonical SMILESCACTVS3.385 CC(=O)Nc1ccc(NC(=O)c2oc(cc2)C(C)=O)cc1
Canonical SMILESOpenEye OEToolkits2.0.7 CC(=O)c1ccc(o1)C(=O)Nc2ccc(cc2)NC(=O)C
InChIInChI1.06 InChI=1S/C15H14N2O4/c1-9(18)13-7-8-14(21-13)15(20)17-12-5-3-11(4-6-12)16-10(2)19/h3-8H,1-2H3,(H,16,19)(H,17,20)
InChIKeyInChI1.06 VLEXAUHLNJBZLL-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 155427942
ChEMBL CHEMBL5077469