3-[(2S)-2-cyclohexylpyrrolidin-1-ium-1-yl]propanoate

Systemtic Name: 3-[(2S)-2-cyclohexylpyrrolidin-1-ium-1-yl]propanoate Openeye Name: 3-[(2S)-2-cyclohexylpyrrolidin-1-ium-1-yl]propanoate CAS Name: 3-[(2S)-2-cyclohexyl-1-pyrrolidin-1-iumyl]propanoate IUPAC Name: 3-[(2S)-2-cyclohexylpyrrolidin-1-ium-1-yl]propanoate Traditional Name: 3-[(2S)-2-cyclohexylpyrrolidin-1-ium-1-yl]propionate Formula: C13H23NO2 MolecularWeight: 225.32722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CCC[NH+]2CCC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)[C@@H]2CCC[NH+]2CCC(=O)[O-]

InChI

InChI=1S/C13H23NO2/c15-13(16)8-10-14-9-4-7-12(14)11-5-2-1-3-6-11/h11-12H,1-10H2,(H,15,16)/t12-/m0/s1