3-[3-(2-carboxyethyl)phenyl]propanoic acid

Systemtic Name: 3-[3-(2-carboxyethyl)phenyl]propanoic acid Openeye Name: 3-[3-(2-carboxyethyl)phenyl]propanoic acid CAS Name: 3-[3-(2-carboxyethyl)phenyl]propanoic acid IUPAC Name: 3-[3-(2-carboxyethyl)phenyl]propanoic acid Traditional Name: 3-[3-(2-carboxyethyl)phenyl]propionic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CCC(=O)O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C12H14O4/c13-11(14)6-4-9-2-1-3-10(8-9)5-7-12(15)16/h1-3,8H,4-7H2,(H,13,14)(H,15,16)