3,4-bis(phenylmethyl)piperazine-1,3-dicarboxylic acid

Systemtic Name: 3,4-bis(phenylmethyl)piperazine-1,3-dicarboxylic acid Openeye Name: 3,4-dibenzylpiperazine-1,3-dicarboxylic acid CAS Name: 3,4-bis(phenylmethyl)piperazine-1,3-dicarboxylic acid IUPAC Name: 3,4-dibenzylpiperazine-1,3-dicarboxylic acid Traditional Name: 3,4-dibenzylpiperazine-1,3-dicarboxylic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)O)(CC2=CC=CC=C2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C(CN1C(=O)O)(CC2=CC=CC=C2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O4/c23-18(24)20(13-16-7-3-1-4-8-16)15-21(19(25)26)11-12-22(20)14-17-9-5-2-6-10-17/h1-10H,11-15H2,(H,23,24)(H,25,26)