2-[4-(4-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[4-(4-methyl-2-oxidanyl-phenyl)carbonylpiperazin-1-yl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[4-(2-hydroxy-4-methyl-benzoyl)piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[4-[(2-hydroxy-4-methylphenyl)-oxomethyl]-1-piperazinyl]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[4-(2-hydroxy-4-methylbenzoyl)piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[4-(2-hydroxy-4-methyl-benzoyl)piperazino]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C21H22F3N3O4 MolecularWeight: 437.41229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F)O

InChI

InChI=1S/C21H22F3N3O4/c1-14-2-7-17(18(28)12-14)20(30)27-10-8-26(9-11-27)13-19(29)25-15-3-5-16(6-4-15)31-21(22,23)24/h2-7,12,28H,8-11,13H2,1H3,(H,25,29)