[(2R,3R)-3-bromanyl-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] ethanoate

Systemtic Name: [(2R,3R)-3-bromanyl-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] ethanoate Openeye Name: [(2R,3R)-3-bromo-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] acetate CAS Name: acetic acid [(2R,3R)-3-bromo-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] ester IUPAC Name: [(2R,3R)-3-bromo-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] acetate Traditional Name: acetic acid [(2R,3R)-3-bromo-3-(3,4-dimethoxyphenyl)-2-(2-methoxyphenoxy)propyl] ester Formula: C20H23BrO6 MolecularWeight: 439.29702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C1=CC(=C(C=C1)OC)OC)Br)OC2=CC=CC=C2OC

Isomeric SMILES

CC(=O)OC[C@H]([C@@H](C1=CC(=C(C=C1)OC)OC)Br)OC2=CC=CC=C2OC

InChI

InChI=1S/C20H23BrO6/c1-13(22)26-12-19(27-17-8-6-5-7-15(17)23-2)20(21)14-9-10-16(24-3)18(11-14)25-4/h5-11,19-20H,12H2,1-4H3/t19-,20-/m1/s1