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CHEBI:114944 - 2-furancarboxylic acid [4-(6-amino-5-cyano-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester

ChEBI IDCHEBI:114944
ChEBI Name2-furancarboxylic acid [4-(6-amino-5-cyano-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester
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Last Modified11 May 2016
DownloadsMolfile
FormulaC21H18N4O4
Net Charge0
Average Mass390.399
Monoisotopic Mass390.13281
SMILESCC(C)c1nnc2c1C(c1ccc(OC(=O)c3ccco3)cc1)C(C#N)=C(N)O2
InChIInChI=1S/C21H18N4O4/c1-11(2)18-17-16(14(10-22)19(23)29-20(17)25-24-18)12-5-7-13(8-6-12)28-21(26)15-4-3-9-27-15/h3-9,11,16H,23H2,1-2H3,(H,24,25)
InChIKeyOFHLATCYEMCERE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-furancarboxylic acid [4-(6-amino-5-cyano-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester (CHEBI:114944) is a 2-furoate ester (CHEBI:50856)
2-furancarboxylic acid [4-(6-amino-5-cyano-3-propan-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl] ester (CHEBI:114944) is a pyranopyrazole (CHEBI:131903)
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