Molecule ID: 70679096

IUPAC Name: 4-methoxy-4-oxo-3-phenylbutanoate

Description: The molecule is a monocarboxylic acid anion that is the conjugate base of 4-methoxy-4-oxo-3-phenylbutanoic acid, obtained by deprotonation of the carboxy group. It is a conjugate base of a 4-methoxy-4-oxo-3-phenylbutanoic acid.

SMILES: COC(=O)C(CC(=O)[O-])c1ccccc1

SELFIES: [C][O][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C11H12O4/c1-15-11(14)9(7-10(12)13)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3,(H,12,13)/p-1

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 1.9