Molecule ID: 9542989

IUPAC Name: 3-[(E)-3-carboxy-3-oxoprop-1-enyl]-2-hydroxybenzoic acid

Description: The molecule is an oxo dicarboxylic acid consisting of pyruvic acid having a 2-hydroxy-3-carboxybenzylidene group at the 3-position. It derives from a pyruvic acid.

SMILES: O=C(O)C(=O)/C=C/c1cccc(C(=O)O)c1O

SELFIES: [O][=C][Branch1][C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][O]

InChI: InChI=1S/C11H8O6/c12-8(11(16)17)5-4-6-2-1-3-7(9(6)13)10(14)15/h1-5,13H,(H,14,15)(H,16,17)/b5-4+

Molecular Properties:
- Polar Surface Area: 112.0 Ų
- LogP: 1.5