Molecule ID: 25203495

IUPAC Name: (2S)-2-amino-3-cyanopropanoate

Description: The molecule is the conjugate base of 3-cyano-L-alanine; major species at pH 7.3. It is a L-alpha-amino acid anion and a cyanoamino acid anion. It is a conjugate base of a 3-cyano-L-alanine and a 3-cyano-L-alanine zwitterion.

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

SELFIES: [N][#C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)/p-1/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 89.9 Ų
- LogP: -3.0