3-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]-2-(4-phenylphenyl)carbonyloxy-benzoic acid

Systemtic Name: 3-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]-2-(4-phenylphenyl)carbonyloxy-benzoic acid Openeye Name: 3-[12-(2,2-diacetoxypropanoyloxy)dodecoxy]-2-(4-phenylbenzoyl)oxy-benzoic acid CAS Name: 3-[12-(2,2-diacetyloxy-1-oxopropoxy)dodecoxy]-2-[oxo-(4-phenylphenyl)methoxy]benzoic acid IUPAC Name: 3-[12-(2,2-diacetyloxypropanoyloxy)dodecoxy]-2-(4-phenylbenzoyl)oxybenzoic acid Traditional Name: 3-[12-(2,2-diacetoxypropanoyloxy)dodecoxy]-2-(4-phenylbenzoyl)oxy-benzoic acid Formula: C39H46O11 MolecularWeight: 690.77594

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(C(=O)OCCCCCCCCCCCCOC1=CC=CC(=C1OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC(C)(C(=O)OCCCCCCCCCCCCOC1=CC=CC(=C1OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)OC(=O)C

InChI

InChI=1S/C39H46O11/c1-28(40)49-39(3,50-29(2)41)38(45)47-27-16-11-9-7-5-4-6-8-10-15-26-46-34-21-17-20-33(36(42)43)35(34)48-37(44)32-24-22-31(23-25-32)30-18-13-12-14-19-30/h12-14,17-25H,4-11,15-16,26-27H2,1-3H3,(H,42,43)