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

Systemtic Name: (2S)-1-[4-(4-aminocarbonylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[4-(4-carbamoylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[4-(4-carbamoyl-1-piperidin-1-iumyl)-1-oxobutyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[4-(4-carbamoylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[4-(4-carbamoylpiperidin-1-ium-1-yl)butanoyl]pyrrolidine-2-carboxylate Formula: C15H25N3O4 MolecularWeight: 311.3767

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O4/c16-14(20)11-5-9-17(10-6-11)7-2-4-13(19)18-8-1-3-12(18)15(21)22/h11-12H,1-10H2,(H2,16,20)(H,21,22)/t12-/m0/s1