[4-hexoxy-2-oxidanylidene-7-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-chromen-3-yl] benzoate

Systemtic Name: [4-hexoxy-2-oxidanylidene-7-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-chromen-3-yl] benzoate Openeye Name: [4-hexoxy-2-oxo-7-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-chromen-3-yl] benzoate CAS Name: benzoic acid [4-hexoxy-2-oxo-7-[[3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-1-benzopyran-3-yl] ester IUPAC Name: [4-hexoxy-2-oxo-7-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxychromen-3-yl] benzoate Traditional Name: benzoic acid [4-hexoxy-2-keto-7-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-chromen-3-yl] ester Formula: C36H40O15 MolecularWeight: 712.6938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C36H40O15/c1-6-7-8-12-17-43-29-26-16-15-25(18-27(26)49-35(42)32(29)51-34(41)24-13-10-9-11-14-24)48-36-33(47-23(5)40)31(46-22(4)39)30(45-21(3)38)28(50-36)19-44-20(2)37/h9-11,13-16,18,28,30-31,33,36H,6-8,12,17,19H2,1-5H3