2-Amino-4-{3-[(4-bromophenoxy)methyl]-2,5-dimethylphenyl}-1-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile

ChemSpider ID: 2850326
Molecular Formula: C₃₁H₂₇BrFN₃O₂
Monoisotopic mass: 571.127075 Da
Systematic name

2-Amino-4-{3-[(4-bromophenoxy)methyl]-2,5-dimethylphenyl}-1-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SMILES and InChIs

SMILES:

Brc5ccc(OCc1cc(cc(c1C)C3C=2C(=O)CCCC=2N(C(=C3\C#N)\N)c4ccc(F)cc4)C)cc5 Copied

Std. InChI:

InChI=1S/C31H27BrFN3O2/c1-18-14-20(17-38-24-12-6-21(32)7-13-24)19(2)25(15-18)29-26(16-34)31(35)36(23-10-8-22(33)9-11-23)27-4-3-5-28(37)30(27)29/h6-15,29H,3-5,17,35H2,1-2H3 Copied

Std. InChIKey:

FFQDQSXUICFGDV-UHFFFAOYSA-N Copied

ChemSpider Searches

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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