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CHEBI:93962 - (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester

ChEBI IDCHEBI:93962
ChEBI Name(4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester
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DownloadsMolfile
FormulaC16H15F3N2O4
Net Charge0
Average Mass356.300
Monoisotopic Mass356.09839
SMILESCOC(=O)C1=C(C)NC(C)=C([N+](=O)[O-])[C@H]1c1ccccc1C(F)(F)F
InChIInChI=1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3/t13-/m0/s1
InChIKeyZFLWDHHVRRZMEI-ZDUSSCGKSA-N
ChEBI Ontology
Outgoing Relation(s)
(4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester (CHEBI:93962) is a (trifluoromethyl)benzenes (CHEBI:83565)
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LSM-4545LINCS