1-(4-pentan-3-ylpiperazin-1-yl)-4-[4-(trifluoromethyloxy)phenyl]butane-1,4-dione

Systemtic Name: 1-(4-pentan-3-ylpiperazin-1-yl)-4-[4-(trifluoromethyloxy)phenyl]butane-1,4-dione Openeye Name: 1-[4-(1-ethylpropyl)piperazin-1-yl]-4-[4-(trifluoromethoxy)phenyl]butane-1,4-dione CAS Name: 1-(4-pentan-3-yl-1-piperazinyl)-4-[4-(trifluoromethoxy)phenyl]butane-1,4-dione IUPAC Name: 1-(4-pentan-3-ylpiperazin-1-yl)-4-[4-(trifluoromethoxy)phenyl]butane-1,4-dione Traditional Name: 1-[4-(1-ethylpropyl)piperazino]-4-[4-(trifluoromethoxy)phenyl]butane-1,4-dione Formula: C20H27F3N2O3 MolecularWeight: 400.43519

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C20H27F3N2O3/c1-3-16(4-2)24-11-13-25(14-12-24)19(27)10-9-18(26)15-5-7-17(8-6-15)28-20(21,22)23/h5-8,16H,3-4,9-14H2,1-2H3