3-[(2R)-2-(1-ethylpyrazol-3-yl)pyrrolidin-1-ium-1-yl]propanoate

Systemtic Name: 3-[(2R)-2-(1-ethylpyrazol-3-yl)pyrrolidin-1-ium-1-yl]propanoate Openeye Name: 3-[(2R)-2-(1-ethylpyrazol-3-yl)pyrrolidin-1-ium-1-yl]propanoate CAS Name: 3-[(2R)-2-(1-ethyl-3-pyrazolyl)-1-pyrrolidin-1-iumyl]propanoate IUPAC Name: 3-[(2R)-2-(1-ethylpyrazol-3-yl)pyrrolidin-1-ium-1-yl]propanoate Traditional Name: 3-[(2R)-2-(1-ethylpyrazol-3-yl)pyrrolidin-1-ium-1-yl]propionate Formula: C12H19N3O2 MolecularWeight: 237.29816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C2CCC[NH+]2CCC(=O)[O-]

Isomeric SMILES

CCN1C=CC(=N1)[C@H]2CCC[NH+]2CCC(=O)[O-]

InChI

InChI=1S/C12H19N3O2/c1-2-15-9-5-10(13-15)11-4-3-7-14(11)8-6-12(16)17/h5,9,11H,2-4,6-8H2,1H3,(H,16,17)/t11-/m1/s1