78050-80-3
3-QUINOLINECARBOXYLIC ACID, 1,4,5,6,7,8-HEXAHYDRO-5-OXO-4-(2-(TRIFLUOR OMETHYL)PHENYL)-2,7,7-TRIMETHYL-, ETHYL ESTER
Name
3-QUINOLINECARBOXYLIC ACID, 1,4,5,6,7,8-HEXAHYDRO-5-OXO-4-(2-(TRIFLUOR OMETHYL)PHENYL)-2,7,7-TRIMETHYL-, ETHYL ESTER
pro_formula
C22 H24 F3 N O3
pro_molWeight
407.43
1Identification
【Name】
3-QUINOLINECARBOXYLIC ACID, 1,4,5,6,7,8-HEXAHYDRO-5-OXO-4-(2-(TRIFLUOR OMETHYL)PHENYL)-2,7,7-TRIMETHYL-, ETHYL ESTER
【CAS】
【MDL】
MFCD00345039
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C22 H24 F3 N O3
【pro_molWeight】
407.43
【Inchi】
InChI=1S/C22H24F3NO3/c1-5-29-20(28)17-12(2)26-15-10-21(3,4)11-16(27)19(15)18(17)13-8-6-7-9-14(13)22(23,24)25/h6-9,18,26H,5,10-11H2,1-4H3
【InChIKey】
InChIKey=ADRLFQYAAGFRPK-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(NC2=C(C1c3ccccc3C(F)(F)F)C(=O)CC(C2)(C)C)C
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:0.0
Bulk/Fine:F