[(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-(2-bromanylethanoyloxy)hex-2-enoate

Systemtic Name: [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-(2-bromanylethanoyloxy)hex-2-enoate Openeye Name: [(1S,4R)-5,5-diethoxy-4-(4-methoxyphenoxy)-1-methyl-pentyl] (E,5R)-5-(2-bromoacetyl)oxyhex-2-enoate CAS Name: (E,5R)-5-(2-bromo-1-oxoethoxy)-2-hexenoic acid [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] ester IUPAC Name: [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-(2-bromoacetyl)oxyhex-2-enoate Traditional Name: (E,5R)-5-(2-bromoacetyl)oxyhex-2-enoic acid [(1S,4R)-5,5-diethoxy-4-(4-methoxyphenoxy)-1-methyl-pentyl] ester Formula: C25H37BrO8 MolecularWeight: 545.46048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(CCC(C)OC(=O)C=CCC(C)OC(=O)CBr)OC1=CC=C(C=C1)OC)OCC

Isomeric SMILES

CCOC([C@@H](CC[C@H](C)OC(=O)/C=C/C[C@@H](C)OC(=O)CBr)OC1=CC=C(C=C1)OC)OCC

InChI

InChI=1S/C25H37BrO8/c1-6-30-25(31-7-2)22(34-21-14-12-20(29-5)13-15-21)16-11-19(4)32-23(27)10-8-9-18(3)33-24(28)17-26/h8,10,12-15,18-19,22,25H,6-7,9,11,16-17H2,1-5H3/b10-8+/t18-,19+,22-/m1/s1