(2S)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butanoate

Systemtic Name: (2S)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butanoate Openeye Name: (2S)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butanoate CAS Name: (2S)-3-methyl-2-(4-methyl-1-piperazin-1-iumyl)butanoate IUPAC Name: (2S)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butanoate Traditional Name: (2S)-3-methyl-2-(4-methylpiperazin-1-ium-1-yl)butyrate Formula: C10H20N2O2 MolecularWeight: 200.278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H20N2O2/c1-8(2)9(10(13)14)12-6-4-11(3)5-7-12/h8-9H,4-7H2,1-3H3,(H,13,14)/t9-/m0/s1