[(2R,5S)-5-butoxy-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate

Systemtic Name: [(2R,5S)-5-butoxy-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate Openeye Name: [(2R,5S)-5-butoxy-3-(4-methylbenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2R,5S)-5-butoxy-3-[(4-methylphenyl)-oxomethoxy]-2-oxolanyl]methyl ester IUPAC Name: [(2R,5S)-5-butoxy-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2R,5S)-5-butoxy-3-p-toluoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1CC(C(O1)COC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCO[C@@H]1CC([C@H](O1)COC(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H30O6/c1-4-5-14-28-23-15-21(31-25(27)20-12-8-18(3)9-13-20)22(30-23)16-29-24(26)19-10-6-17(2)7-11-19/h6-13,21-23H,4-5,14-16H2,1-3H3/t21?,22-,23+/m1/s1