2-[[4-(2-carboxyethyl)piperazin-1-yl]methyl]propanedioic acid

Systemtic Name: 2-[[4-(2-carboxyethyl)piperazin-1-yl]methyl]propanedioic acid Openeye Name: 2-[[4-(2-carboxyethyl)piperazin-1-yl]methyl]propanedioic acid CAS Name: 2-[[4-(2-carboxyethyl)-1-piperazinyl]methyl]propanedioic acid IUPAC Name: 2-[[4-(2-carboxyethyl)piperazin-1-yl]methyl]propanedioic acid Traditional Name: 2-[[4-(2-carboxyethyl)piperazino]methyl]malonic acid Formula: C11H18N2O6 MolecularWeight: 274.27042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)CC(C(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1CCC(=O)O)CC(C(=O)O)C(=O)O

InChI

InChI=1S/C11H18N2O6/c14-9(15)1-2-12-3-5-13(6-4-12)7-8(10(16)17)11(18)19/h8H,1-7H2,(H,14,15)(H,16,17)(H,18,19)