4,4-bis(chloranyl)-3-(2,4-dimethoxy-6-oxidanyl-phenyl)butane-1,3-diol

Systemtic Name: 4,4-bis(chloranyl)-3-(2,4-dimethoxy-6-oxidanyl-phenyl)butane-1,3-diol Openeye Name: 4,4-dichloro-3-(2-hydroxy-4,6-dimethoxy-phenyl)butane-1,3-diol CAS Name: 4,4-dichloro-3-(2-hydroxy-4,6-dimethoxyphenyl)butane-1,3-diol IUPAC Name: 4,4-dichloro-3-(2-hydroxy-4,6-dimethoxyphenyl)butane-1,3-diol Traditional Name: 4,4-dichloro-3-(2-hydroxy-4,6-dimethoxy-phenyl)butane-1,3-diol Formula: C12H16Cl2O5 MolecularWeight: 311.15844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C(CCO)(C(Cl)Cl)O)O

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)C(CCO)(C(Cl)Cl)O)O

InChI

InChI=1S/C12H16Cl2O5/c1-18-7-5-8(16)10(9(6-7)19-2)12(17,3-4-15)11(13)14/h5-6,11,15-17H,3-4H2,1-2H3