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

Systemtic Name: [6-(3-oxidanyl-2-oxidanylidene-4-phenylmethoxy-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [3,4,5-tribenzoyloxy-6-(4-benzyloxy-3-hydroxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4,5-tribenzoyloxy-6-[(3-hydroxy-2-oxo-4-phenylmethoxy-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tribenzoyloxy-6-(3-hydroxy-2-oxo-4-phenylmethoxychromen-7-yl)oxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [6-(4-benzoxy-3-hydroxy-2-keto-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl ester Formula: C50H38O14 MolecularWeight: 862.82832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=O)OC3=C2C=CC(=C3)OC4C(C(C(C(O4)COC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=O)OC3=C2C=CC(=C3)OC4C(C(C(C(O4)COC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)O

InChI

InChI=1S/C50H38O14/c51-40-41(57-29-31-16-6-1-7-17-31)37-27-26-36(28-38(37)60-49(40)56)59-50-44(64-48(55)35-24-14-5-15-25-35)43(63-47(54)34-22-12-4-13-23-34)42(62-46(53)33-20-10-3-11-21-33)39(61-50)30-58-45(52)32-18-8-2-9-19-32/h1-28,39,42-44,50-51H,29-30H2