3-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 3-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 3-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]propanoic acid CAS Name: 3-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]propanoic acid IUPAC Name: 3-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]propanoic acid Traditional Name: 3-(4-hydroxy-3,5-dimethylol-phenyl)propionic acid Formula: C11H14O5 MolecularWeight: 226.22586

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1CO)O)CO)CCC(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1CO)O)CO)CCC(=O)O

InChI

InChI=1S/C11H14O5/c12-5-8-3-7(1-2-10(14)15)4-9(6-13)11(8)16/h3-4,12-13,16H,1-2,5-6H2,(H,14,15)