(2S)-1,3-bis(phenylmethyl)imidazolidin-1-ium-2-carboxylate

Systemtic Name: (2S)-1,3-bis(phenylmethyl)imidazolidin-1-ium-2-carboxylate Openeye Name: (2S)-1,3-dibenzylimidazolidin-1-ium-2-carboxylate CAS Name: (2S)-1,3-bis(phenylmethyl)-2-imidazolidin-1-iumcarboxylate IUPAC Name: (2S)-1,3-dibenzylimidazolidin-1-ium-2-carboxylate Traditional Name: (2S)-1,3-dibenzylimidazolidin-1-ium-2-carboxylate Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C([NH+]1CC2=CC=CC=C2)C(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN([C@@H]([NH+]1CC2=CC=CC=C2)C(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2/c21-18(22)17-19(13-15-7-3-1-4-8-15)11-12-20(17)14-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,21,22)