(2S)-1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-1-oxopropyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]propanoyl]pyrrolidine-2-carboxylate Formula: C14H25N3O4 MolecularWeight: 299.366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25N3O4/c1-11(16-7-5-15(6-8-16)9-10-18)13(19)17-4-2-3-12(17)14(20)21/h11-12,18H,2-10H2,1H3,(H,20,21)/t11-,12-/m0/s1