(2R,4S,5R)-4-(4-methylphenyl)carbonyloxy-5-[(4-methylphenyl)carbonyloxymethyl]oxolane-2-carboxylic acid

Systemtic Name: (2R,4S,5R)-4-(4-methylphenyl)carbonyloxy-5-[(4-methylphenyl)carbonyloxymethyl]oxolane-2-carboxylic acid Openeye Name: (2R,4S,5R)-4-(4-methylbenzoyl)oxy-5-[(4-methylbenzoyl)oxymethyl]tetrahydrofuran-2-carboxylic acid CAS Name: (2R,4S,5R)-4-[(4-methylphenyl)-oxomethoxy]-5-[[(4-methylphenyl)-oxomethoxy]methyl]-2-oxolanecarboxylic acid IUPAC Name: (2R,4S,5R)-4-(4-methylbenzoyl)oxy-5-[(4-methylbenzoyl)oxymethyl]oxolane-2-carboxylic acid Traditional Name: (2R,4S,5R)-4-p-toluoyloxy-5-(p-toluoyloxymethyl)tetrahydrofuran-2-carboxylic acid Formula: C22H22O7 MolecularWeight: 398.40588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)C(=O)O)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H](C[C@@H](O2)C(=O)O)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H22O7/c1-13-3-7-15(8-4-13)21(25)27-12-19-17(11-18(28-19)20(23)24)29-22(26)16-9-5-14(2)6-10-16/h3-10,17-19H,11-12H2,1-2H3,(H,23,24)/t17-,18+,19+/m0/s1