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

Systemtic Name: [6-(3-cyclohexyloxy-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-(cyclohexoxy)-2-oxo-chromen-7-yl]oxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4,5-tribenzoyloxy-6-[(3-cyclohexyloxy-2-oxo-4-phenylmethoxy-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tribenzoyloxy-6-(3-cyclohexyloxy-2-oxo-4-phenylmethoxychromen-7-yl)oxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [6-[4-benzoxy-3-(cyclohexoxy)-2-keto-chromen-7-yl]oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl ester Formula: C56H48O14 MolecularWeight: 944.97192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=C(C3=C(C=C(C=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)OC2=O)OCC9=CC=CC=C9

Isomeric SMILES

C1CCC(CC1)OC2=C(C3=C(C=C(C=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)OC2=O)OCC9=CC=CC=C9

InChI

InChI=1S/C56H48O14/c57-51(37-21-9-2-10-22-37)63-35-45-47(68-52(58)38-23-11-3-12-24-38)48(69-53(59)39-25-13-4-14-26-39)50(70-54(60)40-27-15-5-16-28-40)56(67-45)65-42-31-32-43-44(33-42)66-55(61)49(64-41-29-17-6-18-30-41)46(43)62-34-36-19-7-1-8-20-36/h1-5,7-16,19-28,31-33,41,45,47-48,50,56H,6,17-18,29-30,34-35H2