(2-bromanyl-4-tert-butyl-phenyl) 3-(2-phenoxyethoxy)benzoate

Systemtic Name: (2-bromanyl-4-tert-butyl-phenyl) 3-(2-phenoxyethoxy)benzoate Openeye Name: (2-bromo-4-tert-butyl-phenyl) 3-(2-phenoxyethoxy)benzoate CAS Name: 3-(2-phenoxyethoxy)benzoic acid (2-bromo-4-tert-butylphenyl) ester IUPAC Name: (2-bromo-4-tert-butylphenyl) 3-(2-phenoxyethoxy)benzoate Traditional Name: 3-(2-phenoxyethoxy)benzoic acid (2-bromo-4-tert-butyl-phenyl) ester Formula: C25H25BrO4 MolecularWeight: 469.3676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3)Br

InChI

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