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CHEBI:109087 - 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester

ChEBI IDCHEBI:109087
ChEBI Name6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester
Stars
Last Modified13 April 2017
DownloadsMolfile
FormulaC18H18N2O6
Net Charge0
Average Mass358.350
Monoisotopic Mass358.11649
SMILESCOCCOC(=O)C1=C(C)OC(N)=C(C#N)C1c1ccc2c(c1)OCO2
InChIInChI=1S/C18H18N2O6/c1-10-15(18(21)23-6-5-22-2)16(12(8-19)17(20)26-10)11-3-4-13-14(7-11)25-9-24-13/h3-4,7,16H,5-6,9,20H2,1-2H3
InChIKeyJXYHCJMZBZTZGS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester (CHEBI:109087) is a 2-methoxyethyl ester (CHEBI:136838)
6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester (CHEBI:109087) is a benzodioxoles (CHEBI:38298)
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