2-(2-bromanyl-4-tert-butyl-phenoxy)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4-tert-butyl-phenoxy)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-(2-bromo-4-tert-butylphenoxy)-1-[4-(2-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-bromo-4-tert-butylphenoxy)-1-[4-(2-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-[4-(2-fluorophenyl)piperazino]ethanone Formula: C22H26BrFN2O2 MolecularWeight: 449.356443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=CC=C3F)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=CC=C3F)Br

InChI

InChI=1S/C22H26BrFN2O2/c1-22(2,3)16-8-9-20(17(23)14-16)28-15-21(27)26-12-10-25(11-13-26)19-7-5-4-6-18(19)24/h4-9,14H,10-13,15H2,1-3H3