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

Systemtic Name: [6-(2-oxidanylidene-4-phenylmethoxy-3-undecoxy-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [3,4,5-tribenzoyloxy-6-(4-benzyloxy-2-oxo-3-undecoxy-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [3,4,5-tribenzoyloxy-6-[(2-oxo-4-phenylmethoxy-3-undecoxy-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tribenzoyloxy-6-(2-oxo-4-phenylmethoxy-3-undecoxychromen-7-yl)oxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [6-(4-benzoxy-2-keto-3-undecoxy-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl ester Formula: C61H60O14 MolecularWeight: 1017.1207

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C2=C(C=C(C=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)OC1=O)OCC8=CC=CC=C8

Isomeric SMILES

CCCCCCCCCCCOC1=C(C2=C(C=C(C=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)OC1=O)OCC8=CC=CC=C8

InChI

InChI=1S/C61H60O14/c1-2-3-4-5-6-7-8-9-25-38-67-54-51(68-40-42-26-15-10-16-27-42)48-37-36-47(39-49(48)71-60(54)66)70-61-55(75-59(65)46-34-23-14-24-35-46)53(74-58(64)45-32-21-13-22-33-45)52(73-57(63)44-30-19-12-20-31-44)50(72-61)41-69-56(62)43-28-17-11-18-29-43/h10-24,26-37,39,50,52-53,55,61H,2-9,25,38,40-41H2,1H3