(2S)-1-[(2S)-2-(azepan-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[(2S)-2-(azepan-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[(2S)-2-(azepan-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-(1-azepan-1-iumyl)-1-oxopropyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[(2S)-2-(azepan-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-(azepan-1-ium-1-yl)propanoyl]pyrrolidine-2-carboxylate Formula: C14H24N2O3 MolecularWeight: 268.35196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)[O-])[NH+]2CCCCCC2

Isomeric SMILES

C[C@@H](C(=O)N1CCC[C@H]1C(=O)[O-])[NH+]2CCCCCC2

InChI

InChI=1S/C14H24N2O3/c1-11(15-8-4-2-3-5-9-15)13(17)16-10-6-7-12(16)14(18)19/h11-12H,2-10H2,1H3,(H,18,19)/t11-,12-/m0/s1