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CHEBI:48494 - methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate

ChEBI IDCHEBI:48494
ChEBI Namemethyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate
Stars
ASCII Namemethyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate
DefinitionA phenylalanine derivative that is methyl 4-nitrophenylalaninate substituted by a tert-butoxycarbonyl group at the amino nitrogen.
Last Modified9 January 2015
Submitterhcourrier
DownloadsMolfile
FormulaC15H20N2O6
Net Charge0
Average Mass324.333
Monoisotopic Mass324.13214
SMILESCOC(=O)C(Cc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C
InChIInChI=1S/C15H20N2O6/c1-15(2,3)23-14(19)16-12(13(18)22-4)9-10-5-7-11(8-6-10)17(20)21/h5-8,12H,9H2,1-4H3,(H,16,19)
InChIKeyOIPSJKHEYTWZBQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate (CHEBI:48494) has functional parent tert-butanol (CHEBI:45895)
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate (CHEBI:48494) has functional parent 4-nitrophenylalanine (CHEBI:48496)
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate (CHEBI:48494) is a carbamate ester (CHEBI:23003)
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate (CHEBI:48494) is a phenylalanine derivative (CHEBI:25985)
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate (CHEBI:48494) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
methyl N-(tert-butoxycarbonyl)-4-nitrophenylalaninate
Synonym  Source
methyl 2-[(tert-butoxycarbonyl)amino]-3-(4-nitrophenyl)propanoatePatent
Manual XrefsDatabases
EP1870402Patent