[4-[(4-fluorophenyl)amino]piperidin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone dihydrochloride

Systemtic Name: [4-[(4-fluorophenyl)amino]piperidin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone dihydrochloride Openeye Name: [4-(4-fluoroanilino)-1-piperidyl]-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]methanone dihydrochloride CAS Name: [4-(4-fluoroanilino)-1-piperidinyl]-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]phenyl]methanone dihydrochloride IUPAC Name: [4-(4-fluoroanilino)piperidin-1-yl]-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenyl]methanone dihydrochloride Traditional Name: [4-(4-fluoroanilino)piperidino]-[4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenyl]methanone dihydrochloride Formula: C28H26Cl2F4N4O MolecularWeight: 581.431853

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F.Cl.Cl

Isomeric SMILES

C1CN(CCC1NC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C28H24F4N4O.2ClH/c29-20-4-8-21(9-5-20)34-23-12-15-36(16-13-23)27(37)18-1-6-22(7-2-18)35-25-11-14-33-26-17-19(28(30,31)32)3-10-24(25)26;;/h1-11,14,17,23,34H,12-13,15-16H2,(H,33,35);2*1H