[6-(3-acetyloxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate

Systemtic Name: [6-(3-acetyloxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [6-(3-acetoxy-2-hydroxy-4-oxo-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [6-[(3-acetyloxy-2-hydroxy-4-oxo-1-benzopyran-7-yl)oxy]-3,4,5-tribenzoyloxy-2-oxanyl]methyl ester IUPAC Name: [6-(3-acetyloxy-2-hydroxy-4-oxochromen-7-yl)oxy-3,4,5-tribenzoyloxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [6-(3-acetoxy-2-hydroxy-4-keto-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl ester Formula: C45H34O15 MolecularWeight: 814.74246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)O

Isomeric SMILES

CC(=O)OC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)O

InChI

InChI=1S/C45H34O15/c1-26(46)54-37-35(47)32-23-22-31(24-33(32)56-44(37)52)55-45-39(60-43(51)30-20-12-5-13-21-30)38(59-42(50)29-18-10-4-11-19-29)36(58-41(49)28-16-8-3-9-17-28)34(57-45)25-53-40(48)27-14-6-2-7-15-27/h2-24,34,36,38-39,45,52H,25H2,1H3