(2S)-1-(4-methylpiperazin-1-yl)-2-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(4-methylpiperazin-1-yl)-2-piperazin-4-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(4-methylpiperazin-1-yl)-2-piperazin-4-ium-1-yl-propan-1-one CAS Name: (2S)-1-(4-methyl-1-piperazinyl)-2-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2S)-1-(4-methylpiperazin-1-yl)-2-piperazin-4-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(4-methylpiperazino)-2-piperazin-4-ium-1-yl-propan-1-one Formula: C12H25N4O+ MolecularWeight: 241.3531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C)N2CC[NH2+]CC2

InChI

InChI=1S/C12H24N4O/c1-11(15-5-3-13-4-6-15)12(17)16-9-7-14(2)8-10-16/h11,13H,3-10H2,1-2H3/p+1/t11-/m0/s1