[(2S,3S)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-4-oxidanylidene-2,3-dihydrochromen-3-yl] ethanoate

Systemtic Name: [(2S,3S)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-4-oxidanylidene-2,3-dihydrochromen-3-yl] ethanoate Openeye Name: [(2S,3S)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-4-oxo-chroman-3-yl] acetate CAS Name: acetic acid [(2S,3S)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2S,3S)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-4-oxo-2,3-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [(2S,3S)-2-(2,4-dimethoxyphenyl)-4-keto-5,7-dimethoxy-chroman-3-yl] ester Formula: C21H22O8 MolecularWeight: 402.39458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC2=CC(=CC(=C2C1=O)OC)OC)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)O[C@H]1[C@@H](OC2=CC(=CC(=C2C1=O)OC)OC)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H22O8/c1-11(22)28-21-19(23)18-16(27-5)9-13(25-3)10-17(18)29-20(21)14-7-6-12(24-2)8-15(14)26-4/h6-10,20-21H,1-5H3/t20-,21+/m0/s1