2-bromanyl-1-[3-tert-butyl-5-(4-ethanoylpiperazin-1-yl)-4-methoxy-phenyl]ethanone

Systemtic Name: 2-bromanyl-1-[3-tert-butyl-5-(4-ethanoylpiperazin-1-yl)-4-methoxy-phenyl]ethanone Openeye Name: 1-[3-(4-acetylpiperazin-1-yl)-5-tert-butyl-4-methoxy-phenyl]-2-bromo-ethanone CAS Name: 1-[3-(4-acetyl-1-piperazinyl)-5-tert-butyl-4-methoxyphenyl]-2-bromoethanone IUPAC Name: 1-[3-(4-acetylpiperazin-1-yl)-5-tert-butyl-4-methoxyphenyl]-2-bromoethanone Traditional Name: 1-[3-(4-acetylpiperazino)-5-tert-butyl-4-methoxy-phenyl]-2-bromo-ethanone Formula: C19H27BrN2O3 MolecularWeight: 411.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC(=CC(=C2OC)C(C)(C)C)C(=O)CBr

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC(=CC(=C2OC)C(C)(C)C)C(=O)CBr

InChI

InChI=1S/C19H27BrN2O3/c1-13(23)21-6-8-22(9-7-21)16-11-14(17(24)12-20)10-15(18(16)25-5)19(2,3)4/h10-11H,6-9,12H2,1-5H3