2,2,2-tris(fluoranyl)-1-[2-methyl-4-(4-methylsulfonylphenyl)-6-piperidin-1-yl-quinolin-3-yl]ethanone

Systemtic Name: 2,2,2-tris(fluoranyl)-1-[2-methyl-4-(4-methylsulfonylphenyl)-6-piperidin-1-yl-quinolin-3-yl]ethanone Openeye Name: 2,2,2-trifluoro-1-[2-methyl-4-(4-methylsulfonylphenyl)-6-(1-piperidyl)-3-quinolyl]ethanone CAS Name: 2,2,2-trifluoro-1-[2-methyl-4-(4-methylsulfonylphenyl)-6-(1-piperidinyl)-3-quinolinyl]ethanone IUPAC Name: 2,2,2-trifluoro-1-[2-methyl-4-(4-methylsulfonylphenyl)-6-piperidin-1-ylquinolin-3-yl]ethanone Traditional Name: 2,2,2-trifluoro-1-[4-(4-mesylphenyl)-2-methyl-6-piperidino-3-quinolyl]ethanone Formula: C24H23F3N2O3S MolecularWeight: 476.51123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=C(C=CC2=N1)N3CCCCC3)C4=CC=C(C=C4)S(=O)(=O)C)C(=O)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C2C=C(C=CC2=N1)N3CCCCC3)C4=CC=C(C=C4)S(=O)(=O)C)C(=O)C(F)(F)F

InChI

InChI=1S/C24H23F3N2O3S/c1-15-21(23(30)24(25,26)27)22(16-6-9-18(10-7-16)33(2,31)32)19-14-17(8-11-20(19)28-15)29-12-4-3-5-13-29/h6-11,14H,3-5,12-13H2,1-2H3