[(2S,3S,4S)-4-(hydroxymethyl)-3,4-dimethyl-5-oxidanylidene-oxolan-2-yl] benzoate

Systemtic Name: [(2S,3S,4S)-4-(hydroxymethyl)-3,4-dimethyl-5-oxidanylidene-oxolan-2-yl] benzoate Openeye Name: [(2S,3S,4S)-4-(hydroxymethyl)-3,4-dimethyl-5-oxo-tetrahydrofuran-2-yl] benzoate CAS Name: benzoic acid [(2S,3S,4S)-4-(hydroxymethyl)-3,4-dimethyl-5-oxo-2-oxolanyl] ester IUPAC Name: [(2S,3S,4S)-4-(hydroxymethyl)-3,4-dimethyl-5-oxooxolan-2-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4S)-5-keto-3,4-dimethyl-4-methylol-tetrahydrofuran-2-yl] ester Formula: C14H16O5 MolecularWeight: 264.27384

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)C1(C)CO)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C14H16O5/c1-9-12(19-13(17)14(9,2)8-15)18-11(16)10-6-4-3-5-7-10/h3-7,9,12,15H,8H2,1-2H3/t9-,12+,14-/m1/s1