(2S)-1-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-(4-methyl-1-piperazin-1-iumyl)-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate Formula: C12H21N3O3 MolecularWeight: 255.31344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC(=O)N2CCCC2C(=O)[O-]

Isomeric SMILES

CN1CC[NH+](CC1)CC(=O)N2CCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C12H21N3O3/c1-13-5-7-14(8-6-13)9-11(16)15-4-2-3-10(15)12(17)18/h10H,2-9H2,1H3,(H,17,18)/t10-/m0/s1