Molecule ID: 56927885

IUPAC Name: 5-oxo-5-[4-[(Z)-2-phenylethenyl]anilino]pentanoic acid

Description: The molecule is a stilbenoid obtained by formal condensation of the amino group of (Z)-4-aminostilbene with one of the carboxy groups of glutaric acid. It is a stilbenoid, a monocarboxylic acid and a dicarboxylic acid monoamide.

SMILES: O=C(O)CCCC(=O)Nc1ccc(/C=C\c2ccccc2)cc1

SELFIES: [O][=C][Branch1][C][O][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][O][/C][=C][\C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C]

InChI: InChI=1S/C19H19NO3/c21-18(7-4-8-19(22)23)20-17-13-11-16(12-14-17)10-9-15-5-2-1-3-6-15/h1-3,5-6,9-14H,4,7-8H2,(H,20,21)(H,22,23)/b10-9-

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 3.2