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

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-1-ethyl-6-(trifluoromethyl)quinolin-4-one Openeye Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(trifluoromethyl)quinolin-4-one CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-ethyl-6-(trifluoromethyl)-4-quinolinone IUPAC Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(trifluoromethyl)quinolin-4-one Traditional Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(trifluoromethyl)-4-quinolone Formula: C23H21ClF3N3O2 MolecularWeight: 463.87995

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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=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClF3N3O2/c1-2-28-14-19(21(31)18-12-15(23(25,26)27)6-7-20(18)28)22(32)30-10-8-29(9-11-30)17-5-3-4-16(24)13-17/h3-7,12-14H,2,8-11H2,1H3