2-(4-bromanyl-2-ethanoyl-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-bromanyl-2-ethanoyl-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(2-acetyl-4-bromo-phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-(2-acetyl-4-bromophenoxy)-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(2-acetyl-4-bromophenoxy)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(2-acetyl-4-bromo-phenoxy)-1-(4-phenylpiperazino)ethanone Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O3/c1-15(24)18-13-16(21)7-8-19(18)26-14-20(25)23-11-9-22(10-12-23)17-5-3-2-4-6-17/h2-8,13H,9-12,14H2,1H3