[6-(4-iodanylphenoxy)-3,5-bis(oxidanyl)-4-prop-2-enoxy-oxan-2-yl]methyl 4-chloranylbenzoate

Systemtic Name: [6-(4-iodanylphenoxy)-3,5-bis(oxidanyl)-4-prop-2-enoxy-oxan-2-yl]methyl 4-chloranylbenzoate Openeye Name: [4-allyloxy-3,5-dihydroxy-6-(4-iodophenoxy)tetrahydropyran-2-yl]methyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [3,5-dihydroxy-6-(4-iodophenoxy)-4-prop-2-enoxy-2-oxanyl]methyl ester IUPAC Name: [3,5-dihydroxy-6-(4-iodophenoxy)-4-prop-2-enoxyoxan-2-yl]methyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-allyloxy-3,5-dihydroxy-6-(4-iodophenoxy)tetrahydropyran-2-yl]methyl ester Formula: C22H22ClIO7 MolecularWeight: 560.76335

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1C(C(OC(C1O)OC2=CC=C(C=C2)I)COC(=O)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

C=CCOC1C(C(OC(C1O)OC2=CC=C(C=C2)I)COC(=O)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H22ClIO7/c1-2-11-28-20-18(25)17(12-29-21(27)13-3-5-14(23)6-4-13)31-22(19(20)26)30-16-9-7-15(24)8-10-16/h2-10,17-20,22,25-26H,1,11-12H2