tert-butyl 4-(2-oxidanyl-6-phenylmethoxy-phenyl)carbonyl-3,5-bis(phenylmethoxy)benzoate

Systemtic Name: tert-butyl 4-(2-oxidanyl-6-phenylmethoxy-phenyl)carbonyl-3,5-bis(phenylmethoxy)benzoate Openeye Name: tert-butyl 3,5-dibenzyloxy-4-(2-benzyloxy-6-hydroxy-benzoyl)benzoate CAS Name: 4-[(2-hydroxy-6-phenylmethoxyphenyl)-oxomethyl]-3,5-bis(phenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-hydroxy-6-phenylmethoxybenzoyl)-3,5-bis(phenylmethoxy)benzoate Traditional Name: 3,5-dibenzoxy-4-(2-benzoxy-6-hydroxy-benzoyl)benzoic acid tert-butyl ester Formula: C39H36O7 MolecularWeight: 616.69894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)O)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)O)OCC5=CC=CC=C5

InChI

InChI=1S/C39H36O7/c1-39(2,3)46-38(42)30-22-33(44-25-28-16-9-5-10-17-28)36(34(23-30)45-26-29-18-11-6-12-19-29)37(41)35-31(40)20-13-21-32(35)43-24-27-14-7-4-8-15-27/h4-23,40H,24-26H2,1-3H3