tert-butyl 4-[2-(1,3-dioxan-2-yl)-6-phenylmethoxy-phenyl]carbonyl-3-phenylmethoxy-benzoate

Systemtic Name: tert-butyl 4-[2-(1,3-dioxan-2-yl)-6-phenylmethoxy-phenyl]carbonyl-3-phenylmethoxy-benzoate Openeye Name: tert-butyl 3-benzyloxy-4-[2-benzyloxy-6-(1,3-dioxan-2-yl)benzoyl]benzoate CAS Name: 4-[[2-(1,3-dioxan-2-yl)-6-phenylmethoxyphenyl]-oxomethyl]-3-phenylmethoxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(1,3-dioxan-2-yl)-6-phenylmethoxybenzoyl]-3-phenylmethoxybenzoate Traditional Name: 3-benzoxy-4-[2-benzoxy-6-(1,3-dioxan-2-yl)benzoyl]benzoic acid tert-butyl ester Formula: C36H36O7 MolecularWeight: 580.66684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)C2=C(C=CC=C2OCC3=CC=CC=C3)C4OCCCO4)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C(=O)C2=C(C=CC=C2OCC3=CC=CC=C3)C4OCCCO4)OCC5=CC=CC=C5

InChI

InChI=1S/C36H36O7/c1-36(2,3)43-34(38)27-18-19-28(31(22-27)42-24-26-14-8-5-9-15-26)33(37)32-29(35-39-20-11-21-40-35)16-10-17-30(32)41-23-25-12-6-4-7-13-25/h4-10,12-19,22,35H,11,20-21,23-24H2,1-3H3