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CHEBI:48483 - methyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate

ChEBI IDCHEBI:48483
ChEBI Namemethyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate
Stars
ASCII Namemethyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate
Last Modified20 November 2014
Submitterhcourrier
DownloadsMolfile
FormulaC24H26N2O5
Net Charge0
Average Mass422.481
Monoisotopic Mass422.18417
SMILESCOC(=O)C(Cc1ccc2nc(Oc3ccccc3)ccc2c1)NC(=O)OC(C)(C)C
InChIInChI=1S/C24H26N2O5/c1-24(2,3)31-23(28)26-20(22(27)29-4)15-16-10-12-19-17(14-16)11-13-21(25-19)30-18-8-6-5-7-9-18/h5-14,20H,15H2,1-4H3,(H,26,28)
InChIKeyURJWULOCTKFAJI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate (CHEBI:48483) has functional parent tert-butanol (CHEBI:45895)
methyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate (CHEBI:48483) is a carbamate ester (CHEBI:23003)
methyl N-(tert-butoxycarbonyl)-3-(2-phenoxy-6-quinolyl)alaninate (CHEBI:48483) is a quinolines (CHEBI:26513)
IUPAC Name 
methyl N-(tert-butoxycarbonyl)-3-(2-phenoxyquinolin-6-yl)alaninate
Synonym  Source
methyl 2-[(tert-butoxycarbonyl)amino]-3-(2-phenoxy-6-quinolinyl)propanoatePatent
Manual XrefsDatabases
EP1870402Patent