2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(4-phenylpiperazino)ethanone Formula: C22H27BrN2O2 MolecularWeight: 431.36598

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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=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C22H27BrN2O2/c1-22(2,3)17-9-10-20(19(23)15-17)27-16-21(26)25-13-11-24(12-14-25)18-7-5-4-6-8-18/h4-10,15H,11-14,16H2,1-3H3