(3R,4R)-4-(phenylmethyl)pyrrolidin-1-ium-3-carboxylate

Systemtic Name: (3R,4R)-4-(phenylmethyl)pyrrolidin-1-ium-3-carboxylate Openeye Name: (3R,4R)-4-benzylpyrrolidin-1-ium-3-carboxylate CAS Name: (3R,4R)-4-(phenylmethyl)-3-pyrrolidin-1-iumcarboxylate IUPAC Name: (3R,4R)-4-benzylpyrrolidin-1-ium-3-carboxylate Traditional Name: (3R,4R)-4-benzylpyrrolidin-1-ium-3-carboxylate Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C[NH2+]1)C(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1[C@@H]([C@H](C[NH2+]1)C(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C12H15NO2/c14-12(15)11-8-13-7-10(11)6-9-4-2-1-3-5-9/h1-5,10-11,13H,6-8H2,(H,14,15)/t10-,11-/m0/s1