[(1S,2S,3S)-2-(hydroxymethyl)-3-oxidanyl-cyclobutyl]methyl benzoate

Systemtic Name: [(1S,2S,3S)-2-(hydroxymethyl)-3-oxidanyl-cyclobutyl]methyl benzoate Openeye Name: [(1S,2S,3S)-3-hydroxy-2-(hydroxymethyl)cyclobutyl]methyl benzoate CAS Name: benzoic acid [(1S,2S,3S)-3-hydroxy-2-(hydroxymethyl)cyclobutyl]methyl ester IUPAC Name: [(1S,2S,3S)-3-hydroxy-2-(hydroxymethyl)cyclobutyl]methyl benzoate Traditional Name: benzoic acid [(1S,2S,3S)-3-hydroxy-2-methylol-cyclobutyl]methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1O)CO)COC(=O)C2=CC=CC=C2

Isomeric SMILES

C1[C@@H]([C@H]([C@H]1O)CO)COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16O4/c14-7-11-10(6-12(11)15)8-17-13(16)9-4-2-1-3-5-9/h1-5,10-12,14-15H,6-8H2/t10-,11-,12+/m1/s1