[5-chloranyl-3-(4-methoxyphenyl)carbonyloxy-5-oxidanyl-oxolan-2-yl]methyl 4-methoxybenzoate

Systemtic Name: [5-chloranyl-3-(4-methoxyphenyl)carbonyloxy-5-oxidanyl-oxolan-2-yl]methyl 4-methoxybenzoate Openeye Name: [5-chloro-5-hydroxy-3-(4-methoxybenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [5-chloro-5-hydroxy-3-[(4-methoxyphenyl)-oxomethoxy]-2-oxolanyl]methyl ester IUPAC Name: [5-chloro-5-hydroxy-3-(4-methoxybenzoyl)oxyoxolan-2-yl]methyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (5-chloro-5-hydroxy-3-p-anisoyloxy-tetrahydrofuran-2-yl)methyl ester Formula: C21H21ClO8 MolecularWeight: 436.83964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)(O)Cl)OC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)(O)Cl)OC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21ClO8/c1-26-15-7-3-13(4-8-15)19(23)28-12-18-17(11-21(22,25)30-18)29-20(24)14-5-9-16(27-2)10-6-14/h3-10,17-18,25H,11-12H2,1-2H3