(3S)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-keto-pyrrolidine-3-carboxylate Formula: C12H20N2O3 MolecularWeight: 240.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CN2CC(CC2=O)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCC[C@H]1CN2C[C@H](CC2=O)C(=O)[O-]

InChI

InChI=1S/C12H20N2O3/c1-2-13-5-3-4-10(13)8-14-7-9(12(16)17)6-11(14)15/h9-10H,2-8H2,1H3,(H,16,17)/t9-,10-/m0/s1