3-(3,4-dimethylphenyl)carbonyl-1-(pyridin-2-ylmethyl)-6-(trifluoromethyl)quinolin-4-one

Systemtic Name: 3-(3,4-dimethylphenyl)carbonyl-1-(pyridin-2-ylmethyl)-6-(trifluoromethyl)quinolin-4-one Openeye Name: 3-(3,4-dimethylbenzoyl)-1-(2-pyridylmethyl)-6-(trifluoromethyl)quinolin-4-one CAS Name: 3-[(3,4-dimethylphenyl)-oxomethyl]-1-(2-pyridinylmethyl)-6-(trifluoromethyl)-4-quinolinone IUPAC Name: 3-(3,4-dimethylbenzoyl)-1-(pyridin-2-ylmethyl)-6-(trifluoromethyl)quinolin-4-one Traditional Name: 3-(3,4-dimethylbenzoyl)-1-(2-pyridylmethyl)-6-(trifluoromethyl)-4-quinolone Formula: C25H19F3N2O2 MolecularWeight: 436.42577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)C(F)(F)F)CC4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)C(F)(F)F)CC4=CC=CC=N4)C

InChI

InChI=1S/C25H19F3N2O2/c1-15-6-7-17(11-16(15)2)23(31)21-14-30(13-19-5-3-4-10-29-19)22-9-8-18(25(26,27)28)12-20(22)24(21)32/h3-12,14H,13H2,1-2H3