2-cyclopropyl-N-methyl-N-[[4-[2,2,2-tris(fluoranyl)ethylcarbamoyl]phenyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-methyl-N-[[4-[2,2,2-tris(fluoranyl)ethylcarbamoyl]phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-methyl-N-[[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-methyl-N-[[4-[oxo-(2,2,2-trifluoroethylamino)methyl]phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-methyl-N-[[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-methyl-N-[4-(2,2,2-trifluoroethylcarbamoyl)benzyl]cinchoninamide Formula: C24H22F3N3O2 MolecularWeight: 441.44559

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NCC(F)(F)F)C(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NCC(F)(F)F)C(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C24H22F3N3O2/c1-30(13-15-6-8-17(9-7-15)22(31)28-14-24(25,26)27)23(32)19-12-21(16-10-11-16)29-20-5-3-2-4-18(19)20/h2-9,12,16H,10-11,13-14H2,1H3,(H,28,31)