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

Systemtic Name: [6-(3-acetyloxy-2-oxidanylidene-4-undecoxy-chromen-7-yl)oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [6-(3-acetoxy-2-oxo-4-undecoxy-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [6-[(3-acetyloxy-2-oxo-4-undecoxy-1-benzopyran-7-yl)oxy]-3,4,5-tribenzoyloxy-2-oxanyl]methyl ester IUPAC Name: [6-(3-acetyloxy-2-oxo-4-undecoxychromen-7-yl)oxy-3,4,5-tribenzoyloxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [6-(3-acetoxy-2-keto-4-undecoxy-chromen-7-yl)oxy-3,4,5-tribenzoyloxy-tetrahydropyran-2-yl]methyl ester Formula: C56H56O15 MolecularWeight: 969.03484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C(=O)OC2=C1C=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)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCOC1=C(C(=O)OC2=C1C=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)OC(=O)C

InChI

InChI=1S/C56H56O15/c1-3-4-5-6-7-8-9-10-23-34-63-46-43-33-32-42(35-44(43)67-55(62)49(46)65-37(2)57)66-56-50(71-54(61)41-30-21-14-22-31-41)48(70-53(60)40-28-19-13-20-29-40)47(69-52(59)39-26-17-12-18-27-39)45(68-56)36-64-51(58)38-24-15-11-16-25-38/h11-22,24-33,35,45,47-48,50,56H,3-10,23,34,36H2,1-2H3