Molecule ID: 23615393

IUPAC Name: 2-iminobutanedioate

Description: The molecule is dicarboxylate anion arising from deprotonation of both carboxylic acid groups of iminoaspartic acid. It is a dicarboxylic acid dianion and a C4-dicarboxylate. It is a conjugate base of an iminoaspartic acid and an iminoaspartate(1-).

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

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

InChI: InChI=1S/C4H5NO4/c5-2(4(8)9)1-3(6)7/h5H,1H2,(H,6,7)(H,8,9)/p-2

Molecular Properties:
- Polar Surface Area: 104.0 Ų
- LogP: 0.8