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

Systemtic Name: 1-[6-(azepan-1-yl)-2-methyl-4-phenyl-quinolin-3-yl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[6-(azepan-1-yl)-2-methyl-4-phenyl-3-quinolyl]-2,2,2-trifluoro-ethanone CAS Name: 1-[6-(1-azepanyl)-2-methyl-4-phenyl-3-quinolinyl]-2,2,2-trifluoroethanone IUPAC Name: 1-[6-(azepan-1-yl)-2-methyl-4-phenylquinolin-3-yl]-2,2,2-trifluoroethanone Traditional Name: 1-[6-(azepan-1-yl)-2-methyl-4-phenyl-3-quinolyl]-2,2,2-trifluoro-ethanone Formula: C24H23F3N2O MolecularWeight: 412.44743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=C(C=CC2=N1)N3CCCCCC3)C4=CC=CC=C4)C(=O)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C2C=C(C=CC2=N1)N3CCCCCC3)C4=CC=CC=C4)C(=O)C(F)(F)F

InChI

InChI=1S/C24H23F3N2O/c1-16-21(23(30)24(25,26)27)22(17-9-5-4-6-10-17)19-15-18(11-12-20(19)28-16)29-13-7-2-3-8-14-29/h4-6,9-12,15H,2-3,7-8,13-14H2,1H3