[(2R,3R,4R)-5-bromanyl-4-diphenoxyphosphoryloxy-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate

Systemtic Name: [(2R,3R,4R)-5-bromanyl-4-diphenoxyphosphoryloxy-3-(phenylcarbonyloxy)oxolan-2-yl]methyl benzoate Openeye Name: [(2R,3R,4R)-3-benzoyloxy-5-bromo-4-diphenoxyphosphoryloxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R,4R)-3-benzoyloxy-5-bromo-4-diphenoxyphosphoryloxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4R)-3-benzoyloxy-5-bromo-4-diphenoxyphosphoryloxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R,4R)-3-benzoyloxy-5-bromo-4-diphenoxyphosphoryloxy-tetrahydrofuran-2-yl]methyl ester Formula: C31H26BrO9P MolecularWeight: 653.410501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)Br)OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@H](C(O2)Br)OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H26BrO9P/c32-29-28(41-42(35,39-24-17-9-3-10-18-24)40-25-19-11-4-12-20-25)27(38-31(34)23-15-7-2-8-16-23)26(37-29)21-36-30(33)22-13-5-1-6-14-22/h1-20,26-29H,21H2/t26-,27-,28-,29?/m1/s1