4-[1,3-bis(oxidanyl)propan-2-yloxycarbonyl]benzoic acid

Systemtic Name: 4-[1,3-bis(oxidanyl)propan-2-yloxycarbonyl]benzoic acid Openeye Name: 4-[2-hydroxy-1-(hydroxymethyl)ethoxy]carbonylbenzoic acid CAS Name: 4-[1,3-dihydroxypropan-2-yloxy(oxo)methyl]benzoic acid IUPAC Name: 4-(1,3-dihydroxypropan-2-yloxycarbonyl)benzoic acid Traditional Name: 4-(2-hydroxy-1-methylol-ethoxy)carbonylbenzoic acid Formula: C11H12O6 MolecularWeight: 240.20938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)C(=O)OC(CO)CO

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)C(=O)OC(CO)CO

InChI

InChI=1S/C11H12O6/c12-5-9(6-13)17-11(16)8-3-1-7(2-4-8)10(14)15/h1-4,9,12-13H,5-6H2,(H,14,15)