azepan-1-yl-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone

Systemtic Name: azepan-1-yl-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone Openeye Name: azepan-1-yl-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]methanone CAS Name: 1-azepanyl-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]phenyl]methanone IUPAC Name: azepan-1-yl-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone Traditional Name: azepan-1-yl-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]methanone Formula: C23H22F3N3O MolecularWeight: 413.43549

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C23H22F3N3O/c24-23(25,26)17-7-10-19-20(11-12-27-21(19)15-17)28-18-8-5-16(6-9-18)22(30)29-13-3-1-2-4-14-29/h5-12,15H,1-4,13-14H2,(H,27,28)