[6-(hydroxymethyl)-4-oxidanylidene-pyran-3-yl] benzoate

Systemtic Name: [6-(hydroxymethyl)-4-oxidanylidene-pyran-3-yl] benzoate Openeye Name: [6-(hydroxymethyl)-4-oxo-pyran-3-yl] benzoate CAS Name: benzoic acid [6-(hydroxymethyl)-4-oxo-3-pyranyl] ester IUPAC Name: [6-(hydroxymethyl)-4-oxopyran-3-yl] benzoate Traditional Name: benzoic acid (4-keto-6-methylol-pyran-3-yl) ester Formula: C13H10O5 MolecularWeight: 246.2155

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=COC(=CC2=O)CO

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=COC(=CC2=O)CO

InChI

InChI=1S/C13H10O5/c14-7-10-6-11(15)12(8-17-10)18-13(16)9-4-2-1-3-5-9/h1-6,8,14H,7H2