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

Systemtic Name: 2-bromanyl-3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]butan-1-one Openeye Name: 2-bromo-3-methyl-1-[4-(o-tolyl)piperazin-1-yl]butan-1-one CAS Name: 2-bromo-3-methyl-1-[4-(2-methylphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 2-bromo-3-methyl-1-[4-(2-methylphenyl)piperazin-1-yl]butan-1-one Traditional Name: 2-bromo-3-methyl-1-[4-(o-tolyl)piperazino]butan-1-one Formula: C16H23BrN2O MolecularWeight: 339.27062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C(C(C)C)Br

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C(C(C)C)Br

InChI

InChI=1S/C16H23BrN2O/c1-12(2)15(17)16(20)19-10-8-18(9-11-19)14-7-5-4-6-13(14)3/h4-7,12,15H,8-11H2,1-3H3