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

Systemtic Name: N-(1-methoxybutan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide Openeye Name: N-[1-(methoxymethyl)propyl]-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide CAS Name: N-(1-methoxybutan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-4-quinolinecarboxamide IUPAC Name: N-(1-methoxybutan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide Traditional Name: N-[1-(methoxymethyl)propyl]-2-[4-[3-(trifluoromethyl)phenyl]piperazino]cinchoninamide Formula: C26H29F3N4O2 MolecularWeight: 486.52927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCC(COC)NC(=O)C1=CC(=NC2=CC=CC=C21)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H29F3N4O2/c1-3-19(17-35-2)30-25(34)22-16-24(31-23-10-5-4-9-21(22)23)33-13-11-32(12-14-33)20-8-6-7-18(15-20)26(27,28)29/h4-10,15-16,19H,3,11-14,17H2,1-2H3,(H,30,34)