bis[2-pyridin-2-yl-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone

Systemtic Name: bis[2-pyridin-2-yl-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone Openeye Name: bis[2-(2-pyridyl)-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone CAS Name: bis[2-(2-pyridinyl)-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone IUPAC Name: bis[2-pyridin-2-yl-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone Traditional Name: bis[2-(2-pyridyl)-2,8-bis(trifluoromethyl)-1H-quinolin-4-yl]methanone Formula: C33H18F12N4O MolecularWeight: 714.503058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2(C=C(C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)C4=CC(NC5=C4C=CC=C5C(F)(F)F)(C6=CC=CC=N6)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)C2(C=C(C3=C(N2)C(=CC=C3)C(F)(F)F)C(=O)C4=CC(NC5=C4C=CC=C5C(F)(F)F)(C6=CC=CC=N6)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C33H18F12N4O/c34-30(35,36)21-9-5-7-17-19(15-28(32(40,41)42,48-25(17)21)23-11-1-3-13-46-23)27(50)20-16-29(33(43,44)45,24-12-2-4-14-47-24)49-26-18(20)8-6-10-22(26)31(37,38)39/h1-16,48-49H