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N-(4-Ethoxy-2-nitrophenyl)-3-furancarboxamide

HCID 9943482
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCOc1ccc(NC(=O)c2ccoc2)c([N+](=O)[O-])c1
InChIKey
YWFRTHNTNMFNJJ-UHFFFAOYSA-N
Molecular formula
C13H12N2O5
Average molar mass
276.24 g/mol

Names & identifiers

Preferred name
N-(4-Ethoxy-2-nitrophenyl)-3-furancarboxamide
IUPAC
N-(4-ethoxy-2-nitrophenyl)furan-3-carboxamide

Names & synonyms

SCHEMBL6705959YWFRTHNTNMFNJJ-UHFFFAOYSA-NN-(4-Ethoxy-2-nitrophenyl)-3-furancarboxamide

Database identifiers

PubChem CID
9943482

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
97.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
357

Related reactions

2 records
New reaction record
HRID 92687 reaction equation
HRID 92687As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1007232 reaction equation
HRID 1007232As productuspto-grants-2004_09

Compound notes

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