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

Systemtic Name: (2S)-1-[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-methyl-2-(4-methyl-1-piperazin-1-iumyl)-1-oxopropyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Formula: C14H25N3O3 MolecularWeight: 283.3666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCCC1C(=O)[O-])[NH+]2CCN(CC2)C

Isomeric SMILES

CC(C)(C(=O)N1CCC[C@H]1C(=O)[O-])[NH+]2CCN(CC2)C

InChI

InChI=1S/C14H25N3O3/c1-14(2,16-9-7-15(3)8-10-16)13(20)17-6-4-5-11(17)12(18)19/h11H,4-10H2,1-3H3,(H,18,19)/t11-/m0/s1