2-methanoyl-2-(pyridin-2-ylmethyl)piperazine-1,4-dicarboxylic acid

Systemtic Name: 2-methanoyl-2-(pyridin-2-ylmethyl)piperazine-1,4-dicarboxylic acid Openeye Name: 2-formyl-2-(2-pyridylmethyl)piperazine-1,4-dicarboxylic acid CAS Name: 2-formyl-2-(2-pyridinylmethyl)piperazine-1,4-dicarboxylic acid IUPAC Name: 2-formyl-2-(pyridin-2-ylmethyl)piperazine-1,4-dicarboxylic acid Traditional Name: 2-formyl-2-(2-pyridylmethyl)piperazine-1,4-dicarboxylic acid Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)O)(CC2=CC=CC=N2)C=O)C(=O)O

Isomeric SMILES

C1CN(C(CN1C(=O)O)(CC2=CC=CC=N2)C=O)C(=O)O

InChI

InChI=1S/C13H15N3O5/c17-9-13(7-10-3-1-2-4-14-10)8-15(11(18)19)5-6-16(13)12(20)21/h1-4,9H,5-8H2,(H,18,19)(H,20,21)