(2S)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2S)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: (2S)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-1-[(1-ethyl-4-pyrazolyl)methyl]-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2S)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxylate Formula: C11H17N3O2 MolecularWeight: 223.27158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C[NH+]2CCCC2C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H17N3O2/c1-2-14-8-9(6-12-14)7-13-5-3-4-10(13)11(15)16/h6,8,10H,2-5,7H2,1H3,(H,15,16)/t10-/m0/s1