Molecule ID: 16722161

IUPAC Name: 2-[(2-amino-2-oxoethyl)-(carboxylatomethyl)amino]acetate

Description: The molecule is an ADA and a dicarboxylic acid dianion. It is a conjugate base of a 2,2'-[(2-amino-2-oxoethyl)imino]diacetate(1-). It is a conjugate acid of a 2,2'-[(2-azanidyl-2-oxoethyl)imino]diacetate(3-).

SMILES: N=C([O-])CN(CC(=O)[O-])CC(=O)O

SELFIES: [N][=C][Branch1][C][O-1][C][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O-1][C][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H10N2O5/c7-4(9)1-8(2-5(10)11)3-6(12)13/h1-3H2,(H2,7,9)(H,10,11)(H,12,13)/p-2

Molecular Properties:
- Polar Surface Area: 127.0 Ų
- LogP: -2.6