Molecule ID: 54714350

IUPAC Name: (2Z)-2-[(Z)-3-carboxy-3-oxidoprop-2-enylidene]butanedioate

Description: The molecule is a tricarboxylic acid trianion that is the conjugate base of 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid. It is a conjugate base of a 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid.

SMILES: O=C([O-])C/C(=C/C=C(\[O-])C(=O)O)C(=O)[O-]

SELFIES: [O][=C][Branch1][C][O-1][C][/C][=Branch1][N][=C][/C][=C][Branch1][C][\O-1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C8H8O7/c9-5(8(14)15)2-1-4(7(12)13)3-6(10)11/h1-2,9H,3H2,(H,10,11)(H,12,13)(H,14,15)/p-3/b4-1-,5-2-

Molecular Properties:
- Polar Surface Area: 141.0 Ų
- LogP: 1.5