2-(4-bromanyl-2-ethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-ethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-ethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2-ethylphenoxy)-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-ethylphenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2-ethyl-phenoxy)-1-[4-(4-chlorobenzyl)piperazino]ethanone Formula: C21H24BrClN2O2 MolecularWeight: 451.78446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24BrClN2O2/c1-2-17-13-18(22)5-8-20(17)27-15-21(26)25-11-9-24(10-12-25)14-16-3-6-19(23)7-4-16/h3-8,13H,2,9-12,14-15H2,1H3