[4,5,6-tris(oxidanyl)-2,3-bis(phenylcarbonyloxy)hexyl] benzoate

Systemtic Name: [4,5,6-tris(oxidanyl)-2,3-bis(phenylcarbonyloxy)hexyl] benzoate Openeye Name: (2,3-dibenzoyloxy-4,5,6-trihydroxy-hexyl) benzoate CAS Name: benzoic acid (2,3-dibenzoyloxy-4,5,6-trihydroxyhexyl) ester IUPAC Name: (2,3-dibenzoyloxy-4,5,6-trihydroxyhexyl) benzoate Traditional Name: benzoic acid (2,3-dibenzoyloxy-4,5,6-trihydroxy-hexyl) ester Formula: C27H26O9 MolecularWeight: 494.48994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(C(C(C(CO)O)O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC(C(C(C(CO)O)O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H26O9/c28-16-21(29)23(30)24(36-27(33)20-14-8-3-9-15-20)22(35-26(32)19-12-6-2-7-13-19)17-34-25(31)18-10-4-1-5-11-18/h1-15,21-24,28-30H,16-17H2