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

Systemtic Name: (2S)-2-bromanyl-3-methyl-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: (2S)-1-(4-benzylpiperazin-1-yl)-2-bromo-3-methyl-butan-1-one CAS Name: (2S)-2-bromo-3-methyl-1-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: (2S)-1-(4-benzylpiperazin-1-yl)-2-bromo-3-methylbutan-1-one Traditional Name: (2S)-1-(4-benzylpiperazino)-2-bromo-3-methyl-butan-1-one Formula: C16H23BrN2O MolecularWeight: 339.27062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)CC2=CC=CC=C2)Br

InChI

InChI=1S/C16H23BrN2O/c1-13(2)15(17)16(20)19-10-8-18(9-11-19)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3/t15-/m0/s1