(2S)-2-[[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]amino]propanoate

Systemtic Name: (2S)-2-[[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]amino]propanoate Openeye Name: (2S)-2-[[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]amino]propanoate CAS Name: (2S)-2-[[2-methyl-2-(4-methyl-1-piperazin-1-iumyl)-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-2-[[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]amino]propanoate Traditional Name: (2S)-2-[[2-methyl-2-(4-methylpiperazin-1-ium-1-yl)propanoyl]amino]propionate Formula: C12H23N3O3 MolecularWeight: 257.32932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C(C)(C)[NH+]1CCN(CC1)C

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)C(C)(C)[NH+]1CCN(CC1)C

InChI

InChI=1S/C12H23N3O3/c1-9(10(16)17)13-11(18)12(2,3)15-7-5-14(4)6-8-15/h9H,5-8H2,1-4H3,(H,13,18)(H,16,17)/t9-/m0/s1