N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide

Systemtic Name: N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-butyl-N-methyl-2-[4-[3-(trifluoromethyl)phenyl]piperazino]cinchoninamide Formula: C26H29F3N4O MolecularWeight: 470.52987

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCCCN(C)C(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H29F3N4O/c1-3-4-12-31(2)25(34)22-18-24(30-23-11-6-5-10-21(22)23)33-15-13-32(14-16-33)20-9-7-8-19(17-20)26(27,28)29/h5-11,17-18H,3-4,12-16H2,1-2H3