(2-ethyl-1,3-dioxan-5-yl) benzoate

Systemtic Name: (2-ethyl-1,3-dioxan-5-yl) benzoate Openeye Name: (2-ethyl-1,3-dioxan-5-yl) benzoate CAS Name: benzoic acid (2-ethyl-1,3-dioxan-5-yl) ester IUPAC Name: (2-ethyl-1,3-dioxan-5-yl) benzoate Traditional Name: benzoic acid (2-ethyl-1,3-dioxan-5-yl) ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1OCC(CO1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC1OCC(CO1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16O4/c1-2-12-15-8-11(9-16-12)17-13(14)10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3