(2R)-1,4-bis(phenylmethyl)piperazin-1-ium-2-carboxylate

Systemtic Name: (2R)-1,4-bis(phenylmethyl)piperazin-1-ium-2-carboxylate Openeye Name: (2R)-1,4-dibenzylpiperazin-1-ium-2-carboxylate CAS Name: (2R)-1,4-bis(phenylmethyl)-2-piperazin-1-iumcarboxylate IUPAC Name: (2R)-1,4-dibenzylpiperazin-1-ium-2-carboxylate Traditional Name: (2R)-1,4-dibenzylpiperazin-1-ium-2-carboxylate Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2/c22-19(23)18-15-20(13-16-7-3-1-4-8-16)11-12-21(18)14-17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H,22,23)/t18-/m1/s1