diethyl (2R,5R)-1-(phenylmethyl)pyrrolidin-1-ium-2,5-dicarboxylate

Systemtic Name: diethyl (2R,5R)-1-(phenylmethyl)pyrrolidin-1-ium-2,5-dicarboxylate Openeye Name: diethyl (2R,5R)-1-benzylpyrrolidin-1-ium-2,5-dicarboxylate CAS Name: (2R,5R)-1-(phenylmethyl)pyrrolidin-1-ium-2,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl (2R,5R)-1-benzylpyrrolidin-1-ium-2,5-dicarboxylate Traditional Name: (2R,5R)-1-benzylpyrrolidin-1-ium-2,5-dicarboxylic acid diethyl ester Formula: C17H24NO4+ MolecularWeight: 306.37676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC([NH+]1CC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H]1CC[C@@H]([NH+]1CC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C17H23NO4/c1-3-21-16(19)14-10-11-15(17(20)22-4-2)18(14)12-13-8-6-5-7-9-13/h5-9,14-15H,3-4,10-12H2,1-2H3/p+1/t14-,15-/m1/s1