2-bromanyl-3-methyl-1-[4-(phenylcarbonyl)piperazin-1-yl]butan-1-one

Systemtic Name: 2-bromanyl-3-methyl-1-[4-(phenylcarbonyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzoylpiperazin-1-yl)-2-bromo-3-methyl-butan-1-one CAS Name: 1-(4-benzoyl-1-piperazinyl)-2-bromo-3-methyl-1-butanone IUPAC Name: 1-(4-benzoylpiperazin-1-yl)-2-bromo-3-methylbutan-1-one Traditional Name: 1-(4-benzoylpiperazino)-2-bromo-3-methyl-butan-1-one Formula: C16H21BrN2O2 MolecularWeight: 353.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2)Br

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C16H21BrN2O2/c1-12(2)14(17)16(21)19-10-8-18(9-11-19)15(20)13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3