tert-butyl 4-bromanyl-3,5-bis(phenylmethoxy)benzoate

Systemtic Name: tert-butyl 4-bromanyl-3,5-bis(phenylmethoxy)benzoate Openeye Name: tert-butyl 3,5-dibenzyloxy-4-bromo-benzoate CAS Name: 4-bromo-3,5-bis(phenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-bromo-3,5-bis(phenylmethoxy)benzoate Traditional Name: 3,5-dibenzoxy-4-bromo-benzoic acid tert-butyl ester Formula: C25H25BrO4 MolecularWeight: 469.3676

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)Br)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C25H25BrO4/c1-25(2,3)30-24(27)20-14-21(28-16-18-10-6-4-7-11-18)23(26)22(15-20)29-17-19-12-8-5-9-13-19/h4-15H,16-17H2,1-3H3