[6-carboxyoxy-6-methyl-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate

Systemtic Name: [6-carboxyoxy-6-methyl-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: (3,4,5-tribenzoyloxy-6-carboxyoxy-6-methyl-tetrahydropyran-2-yl)methyl benzoate CAS Name: benzoic acid (3,4,5-tribenzoyloxy-6-carboxyoxy-6-methyl-2-oxanyl)methyl ester IUPAC Name: (3,4,5-tribenzoyloxy-6-carboxyoxy-6-methyloxan-2-yl)methyl benzoate Traditional Name: benzoic acid (3,4,5-tribenzoyloxy-6-carboxyoxy-6-methyl-tetrahydropyran-2-yl)methyl ester Formula: C36H30O12 MolecularWeight: 654.6162

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)O

Isomeric SMILES

CC1(C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)O

InChI

InChI=1S/C36H30O12/c1-36(48-35(41)42)30(46-34(40)26-20-12-5-13-21-26)29(45-33(39)25-18-10-4-11-19-25)28(44-32(38)24-16-8-3-9-17-24)27(47-36)22-43-31(37)23-14-6-2-7-15-23/h2-21,27-30H,22H2,1H3,(H,41,42)