(1S,2R)-2-(5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)-1-(3-methoxy-4-phenylmethoxy-phenyl)propane-1,3-diol

Systemtic Name: (1S,2R)-2-(5-bromanyl-3-methoxy-2-phenylmethoxy-phenyl)-1-(3-methoxy-4-phenylmethoxy-phenyl)propane-1,3-diol Openeye Name: (1S,2R)-2-(2-benzyloxy-5-bromo-3-methoxy-phenyl)-1-(4-benzyloxy-3-methoxy-phenyl)propane-1,3-diol CAS Name: (1S,2R)-2-(5-bromo-3-methoxy-2-phenylmethoxyphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)propane-1,3-diol IUPAC Name: (1S,2R)-2-(5-bromo-3-methoxy-2-phenylmethoxyphenyl)-1-(3-methoxy-4-phenylmethoxyphenyl)propane-1,3-diol Traditional Name: (1S,2R)-2-(2-benzoxy-5-bromo-3-methoxy-phenyl)-1-(4-benzoxy-3-methoxy-phenyl)propane-1,3-diol Formula: C31H31BrO6 MolecularWeight: 579.47824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(CO)C2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Br)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H]([C@@H](CO)C2=CC(=CC(=C2OCC3=CC=CC=C3)OC)Br)O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H31BrO6/c1-35-28-15-23(13-14-27(28)37-19-21-9-5-3-6-10-21)30(34)26(18-33)25-16-24(32)17-29(36-2)31(25)38-20-22-11-7-4-8-12-22/h3-17,26,30,33-34H,18-20H2,1-2H3/t26-,30+/m0/s1