[3-(hydroxymethyl)-2-oxidanylidene-cyclobutyl] benzoate

Systemtic Name: [3-(hydroxymethyl)-2-oxidanylidene-cyclobutyl] benzoate Openeye Name: [3-(hydroxymethyl)-2-oxo-cyclobutyl] benzoate CAS Name: benzoic acid [3-(hydroxymethyl)-2-oxocyclobutyl] ester IUPAC Name: [3-(hydroxymethyl)-2-oxocyclobutyl] benzoate Traditional Name: benzoic acid (2-keto-3-methylol-cyclobutyl) ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C1OC(=O)C2=CC=CC=C2)CO

Isomeric SMILES

C1C(C(=O)C1OC(=O)C2=CC=CC=C2)CO

InChI

InChI=1S/C12H12O4/c13-7-9-6-10(11(9)14)16-12(15)8-4-2-1-3-5-8/h1-5,9-10,13H,6-7H2