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

Systemtic Name: (2S)-2-[3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoylamino]propanoate Openeye Name: (2S)-2-[3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoylamino]propanoate CAS Name: (2S)-2-[[3-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-2-[3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoylamino]propanoate Traditional Name: (2S)-2-[3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoylamino]propionate Formula: C12H23N3O4 MolecularWeight: 273.32872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23N3O4/c1-10(12(18)19)13-11(17)2-3-14-4-6-15(7-5-14)8-9-16/h10,16H,2-9H2,1H3,(H,13,17)(H,18,19)/t10-/m0/s1