methyl 6-bromanyl-2-oxidanyl-6-oxidanylidene-3,4,5-tris(phenylmethoxy)hexanoate

Systemtic Name: methyl 6-bromanyl-2-oxidanyl-6-oxidanylidene-3,4,5-tris(phenylmethoxy)hexanoate Openeye Name: methyl 3,4,5-tribenzyloxy-6-bromo-2-hydroxy-6-oxo-hexanoate CAS Name: 6-bromo-2-hydroxy-6-oxo-3,4,5-tris(phenylmethoxy)hexanoic acid methyl ester IUPAC Name: methyl 6-bromo-2-hydroxy-6-oxo-3,4,5-tris(phenylmethoxy)hexanoate Traditional Name: 3,4,5-tribenzoxy-6-bromo-2-hydroxy-6-keto-hexanoic acid methyl ester Formula: C28H29BrO7 MolecularWeight: 557.42966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C(C(C(=O)Br)OCC1=CC=CC=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C(C(C(C(C(=O)Br)OCC1=CC=CC=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H29BrO7/c1-33-28(32)23(30)24(34-17-20-11-5-2-6-12-20)25(35-18-21-13-7-3-8-14-21)26(27(29)31)36-19-22-15-9-4-10-16-22/h2-16,23-26,30H,17-19H2,1H3