1-ethyl-3-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-6-(trifluoromethyl)quinolin-4-one

Systemtic Name: 1-ethyl-3-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-6-(trifluoromethyl)quinolin-4-one Openeye Name: 1-ethyl-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)quinolin-4-one CAS Name: 1-ethyl-3-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-6-(trifluoromethyl)-4-quinolinone IUPAC Name: 1-ethyl-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)quinolin-4-one Traditional Name: 1-ethyl-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)-4-quinolone Formula: C23H21F4N3O2 MolecularWeight: 447.425353

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C23H21F4N3O2/c1-2-28-14-17(21(31)16-13-15(23(25,26)27)7-8-19(16)28)22(32)30-11-9-29(10-12-30)20-6-4-3-5-18(20)24/h3-8,13-14H,2,9-12H2,1H3