3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-ium-1-yl]propanoate

Systemtic Name: 3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-ium-1-yl]propanoate Openeye Name: 3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-ium-1-yl]propanoate CAS Name: 3-[(2S)-2-(1-pyrazolylmethyl)-1-pyrrolidin-1-iumyl]propanoate IUPAC Name: 3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-ium-1-yl]propanoate Traditional Name: 3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-ium-1-yl]propionate Formula: C11H17N3O2 MolecularWeight: 223.27158

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CCC(=O)[O-])CN2C=CC=N2

Isomeric SMILES

C1C[C@H]([NH+](C1)CCC(=O)[O-])CN2C=CC=N2

InChI

InChI=1S/C11H17N3O2/c15-11(16)4-8-13-6-1-3-10(13)9-14-7-2-5-12-14/h2,5,7,10H,1,3-4,6,8-9H2,(H,15,16)/t10-/m0/s1