(2S)-1-[2-(4-aminocarbonylpiperidin-1-ium-1-yl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(4-aminocarbonylpiperidin-1-ium-1-yl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(4-carbamoylpiperidin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-(4-carbamoyl-1-piperidin-1-iumyl)-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(4-carbamoylpiperidin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(4-carbamoylpiperidin-1-ium-1-yl)acetyl]pyrrolidine-2-carboxylate Formula: C13H21N3O4 MolecularWeight: 283.32354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C[NH+]2CCC(CC2)C(=O)N)C(=O)[O-]

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C[NH+]2CCC(CC2)C(=O)N)C(=O)[O-]

InChI

InChI=1S/C13H21N3O4/c14-12(18)9-3-6-15(7-4-9)8-11(17)16-5-1-2-10(16)13(19)20/h9-10H,1-8H2,(H2,14,18)(H,19,20)/t10-/m0/s1