N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]-4-(trifluoromethyl)benzamide CAS Name: N-[4-[4-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-piperazinyl]phenyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazino]phenyl]-4-(trifluoromethyl)benzamide Formula: C29H25F3N4O3 MolecularWeight: 534.52901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C29H25F3N4O3/c1-39-26-18-25(34-24-5-3-2-4-23(24)26)28(38)36-16-14-35(15-17-36)22-12-10-21(11-13-22)33-27(37)19-6-8-20(9-7-19)29(30,31)32/h2-13,18H,14-17H2,1H3,(H,33,37)