[(2R,3R)-2-[(4-bromophenyl)methoxymethyl]-5-methoxy-oxolan-3-yl]methyl benzoate

Systemtic Name: [(2R,3R)-2-[(4-bromophenyl)methoxymethyl]-5-methoxy-oxolan-3-yl]methyl benzoate Openeye Name: [(2R,3R)-2-[(4-bromophenyl)methoxymethyl]-5-methoxy-tetrahydrofuran-3-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R)-2-[(4-bromophenyl)methoxymethyl]-5-methoxy-3-oxolanyl]methyl ester IUPAC Name: [(2R,3R)-2-[(4-bromophenyl)methoxymethyl]-5-methoxyoxolan-3-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R)-2-[(4-bromobenzyl)oxymethyl]-5-methoxy-tetrahydrofuran-3-yl]methyl ester Formula: C21H23BrO5 MolecularWeight: 435.30832

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(C(O1)COCC2=CC=C(C=C2)Br)COC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1C[C@@H]([C@@H](O1)COCC2=CC=C(C=C2)Br)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23BrO5/c1-24-20-11-17(13-26-21(23)16-5-3-2-4-6-16)19(27-20)14-25-12-15-7-9-18(22)10-8-15/h2-10,17,19-20H,11-14H2,1H3/t17-,19+,20?/m1/s1