2-(4-bromanyl-2,6-dimethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-1-[4-(4-chlorobenzyl)piperazino]ethanone Formula: C21H24BrClN2O2 MolecularWeight: 451.78446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C)Br

InChI

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