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CHEBI:83367 - (R)-binapacryl

ChEBI IDCHEBI:83367
ChEBI Name(R)-binapacryl
Stars
ASCII Name(R)-binapacryl
DefinitionA 2-sec-butyl-4,6-dinitrophenyl 3-methylbut-2-enoate that is the (R)-enantiomer of binapacryl.
Last Modified21 October 2014
SubmitterSteve
DownloadsMolfile
FormulaC15H18N2O6
Net Charge0
Average Mass322.317
Monoisotopic Mass322.11649
SMILESCC[C@@H](C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1OC(=O)C=C(C)C
InChIInChI=1S/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3/t10-/m1/s1
InChIKeyZRDUSMYWDRPZRM-SNVBAGLBSA-N
ChEBI Ontology
Outgoing Relation(s)
(R)-binapacryl (CHEBI:83367) is a 2-sec-butyl-4,6-dinitrophenyl 3-methylbut-2-enoate (CHEBI:83366)
(R)-binapacryl (CHEBI:83367) is enantiomer of (S)-binapacryl (CHEBI:83371)
Incoming Relation(s)
binapacryl (CHEBI:82153) has part (R)-binapacryl (CHEBI:83367)
(S)-binapacryl (CHEBI:83371) is enantiomer of (R)-binapacryl (CHEBI:83367)
IUPAC Name 
2-[(2R)-butan-2-yl]-4,6-dinitrophenyl 3-methylbut-2-enoate