(2S)-2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]propanoate

Systemtic Name: (2S)-2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]propanoate Openeye Name: (2S)-2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]propanoate CAS Name: (2S)-2-[[3-(4-methyl-1-piperazin-4-iumyl)-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]propanoate Traditional Name: (2S)-2-[3-(4-methylpiperazin-4-ium-1-yl)propanoylamino]propionate Formula: C11H21N3O3 MolecularWeight: 243.30274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)CCN1CC[NH+](CC1)C

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)CCN1CC[NH+](CC1)C

InChI

InChI=1S/C11H21N3O3/c1-9(11(16)17)12-10(15)3-4-14-7-5-13(2)6-8-14/h9H,3-8H2,1-2H3,(H,12,15)(H,16,17)/t9-/m0/s1