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CHEBI:138123 - methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate

ChEBI IDCHEBI:138123
ChEBI Namemethyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate
Stars
ASCII Namemethyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate
DefinitionA methyl 2-(4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-methylbenzoate in which the chiral centre has R configuration.
Last Modified16 May 2019
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H20N2O3
Net Charge0
Average Mass288.347
Monoisotopic Mass288.14739
SMILESCOC(=O)c1cc(C)ccc1C1=N[C@](C)(C(C)C)C(=O)N1
InChIInChI=1S/C16H20N2O3/c1-9(2)16(4)15(20)17-13(18-16)11-7-6-10(3)8-12(11)14(19)21-5/h6-9H,1-5H3,(H,17,18,20)/t16-/m1/s1
InChIKeyTYIHVCIQMMTVHE-MRXNPFEDSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138123) has functional parent 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluic acid (CHEBI:138118)
methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138123) is a methyl 2-(4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-methylbenzoate (CHEBI:138122)
methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138123) is enantiomer of methyl 6-[(4S)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138124)
Incoming Relation(s)
rac-methyl 6-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-m-toluate (CHEBI:6853) has part methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138123)
methyl 6-[(4S)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138124) is enantiomer of methyl 6-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-m-toluate (CHEBI:138123)
IUPAC Names 
methyl 2-[(4R)-4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl]-5-methylbenzoate
methyl 5-methyl-2-[(4R)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]benzoate