2-(2-azanyl-4-tert-butyl-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]ethanone

Systemtic Name: 2-(2-azanyl-4-tert-butyl-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]ethanone Openeye Name: 2-(2-amino-4-tert-butyl-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]ethanone CAS Name: 2-(2-amino-4-tert-butylphenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-amino-4-tert-butylphenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]ethanone Traditional Name: 2-(2-amino-4-tert-butyl-phenoxy)-1-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]ethanone Formula: C25H34FN3O2 MolecularWeight: 427.554763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)COC2=C(C=C(C=C2)C(C)(C)C)N)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(C(CN1C(=O)COC2=C(C=C(C=C2)C(C)(C)C)N)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H34FN3O2/c1-17-14-29(18(2)13-28(17)15-19-6-9-21(26)10-7-19)24(30)16-31-23-11-8-20(12-22(23)27)25(3,4)5/h6-12,17-18H,13-16,27H2,1-5H3