[(2S,3R)-2-(3,4-dimethoxyphenyl)-7-phenylmethoxy-3,4-dihydro-2H-chromen-3-yl] ethanoate

Systemtic Name: [(2S,3R)-2-(3,4-dimethoxyphenyl)-7-phenylmethoxy-3,4-dihydro-2H-chromen-3-yl] ethanoate Openeye Name: [(2S,3R)-7-benzyloxy-2-(3,4-dimethoxyphenyl)chroman-3-yl] acetate CAS Name: acetic acid [(2S,3R)-2-(3,4-dimethoxyphenyl)-7-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2S,3R)-2-(3,4-dimethoxyphenyl)-7-phenylmethoxy-3,4-dihydro-2H-chromen-3-yl] acetate Traditional Name: acetic acid [(2S,3R)-7-benzoxy-2-(3,4-dimethoxyphenyl)chroman-3-yl] ester Formula: C26H26O6 MolecularWeight: 434.48104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2=C(C=C(C=C2)OCC3=CC=CC=C3)OC1C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(=O)O[C@@H]1CC2=C(C=C(C=C2)OCC3=CC=CC=C3)O[C@H]1C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H26O6/c1-17(27)31-25-13-19-9-11-21(30-16-18-7-5-4-6-8-18)15-23(19)32-26(25)20-10-12-22(28-2)24(14-20)29-3/h4-12,14-15,25-26H,13,16H2,1-3H3/t25-,26+/m1/s1