3-[(4-fluorophenyl)methyl]piperazine-1,3-dicarboxylic acid

Systemtic Name: 3-[(4-fluorophenyl)methyl]piperazine-1,3-dicarboxylic acid Openeye Name: 3-[(4-fluorophenyl)methyl]piperazine-1,3-dicarboxylic acid CAS Name: 3-[(4-fluorophenyl)methyl]piperazine-1,3-dicarboxylic acid IUPAC Name: 3-[(4-fluorophenyl)methyl]piperazine-1,3-dicarboxylic acid Traditional Name: 3-(4-fluorobenzyl)piperazine-1,3-dicarboxylic acid Formula: C13H15FN2O4 MolecularWeight: 282.267603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)(CC2=CC=C(C=C2)F)C(=O)O)C(=O)O

Isomeric SMILES

C1CN(CC(N1)(CC2=CC=C(C=C2)F)C(=O)O)C(=O)O

InChI

InChI=1S/C13H15FN2O4/c14-10-3-1-9(2-4-10)7-13(11(17)18)8-16(12(19)20)6-5-15-13/h1-4,15H,5-8H2,(H,17,18)(H,19,20)