Molecule ID: 25202539

IUPAC Name: (2S)-2-[(4-aminobenzoyl)amino]pentanedioate

Description: The molecule is a dicarboxylic acid dianion which results from the removal of a proton from each of the carboxylic acid groups of N-(4-aminobenzoyl)-L-glutamic acid. It is a conjugate base of a N-(4-aminobenzoyl)-L-glutamic acid.

SMILES: Nc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1

SELFIES: [N][C][=C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O-1][C][=C][Ring2][Ring1][C]

InChI: InChI=1S/C12H14N2O5/c13-8-3-1-7(2-4-8)11(17)14-9(12(18)19)5-6-10(15)16/h1-4,9H,5-6,13H2,(H,14,17)(H,15,16)(H,18,19)/p-2/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 135.0 Ų
- LogP: 1.3