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CHEBI:40006 - 1-(4-METHOXYPHENYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

Default Structure
ChEBI IDCHEBI:40006
ChEBI Name1-(4-METHOXYPHENYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC15H18N2O3
Net Charge0
Average Mass274.320
Monoisotopic Mass274.13174
SMILES[H]c1c([H])c(-n2nc(C([H])([H])[H])c(C(=O)OC([H])([H])C([H])([H])[H])c2C([H])([H])[H])c([H])c([H])c1OC([H])([H])[H]
InChIInChI=1S/C15H18N2O3/c1-5-20-15(18)14-10(2)16-17(11(14)3)12-6-8-13(19-4)9-7-12/h6-9H,5H2,1-4H3
InChIKeyZDSXCFSUGVAQSB-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(4-METHOXYPHENYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER (CHEBI:40006) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-(4-METHOXYPHENYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTERPDBeChem
ethyl 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylatePDBeChem
Manual XrefsDatabases
4DEPDBeChem