[5-bromanyl-2-(bromomethyl)-6-methoxy-4-oxidanyl-oxan-3-yl] benzoate

Systemtic Name: [5-bromanyl-2-(bromomethyl)-6-methoxy-4-oxidanyl-oxan-3-yl] benzoate Openeye Name: [5-bromo-2-(bromomethyl)-4-hydroxy-6-methoxy-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [5-bromo-2-(bromomethyl)-4-hydroxy-6-methoxy-3-oxanyl] ester IUPAC Name: [5-bromo-2-(bromomethyl)-4-hydroxy-6-methoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [5-bromo-2-(bromomethyl)-4-hydroxy-6-methoxy-tetrahydropyran-3-yl] ester Formula: C14H16Br2O5 MolecularWeight: 424.08184

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)CBr)OC(=O)C2=CC=CC=C2)O)Br

Isomeric SMILES

COC1C(C(C(C(O1)CBr)OC(=O)C2=CC=CC=C2)O)Br

InChI

InChI=1S/C14H16Br2O5/c1-19-14-10(16)11(17)12(9(7-15)20-14)21-13(18)8-5-3-2-4-6-8/h2-6,9-12,14,17H,7H2,1H3