phenethyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoyloxy]benzoate

Systemtic Name: phenethyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoyloxy]benzoate Openeye Name: phenethyl 4-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]oxybenzoate CAS Name: 4-[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethoxy]benzoic acid phenethyl ester IUPAC Name: phenethyl 4-[2-(4-bromo-2-tert-butylphenoxy)acetyl]oxybenzoate Traditional Name: 4-[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]oxybenzoic acid phenethyl ester Formula: C27H27BrO5 MolecularWeight: 511.40428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)OC2=CC=C(C=C2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)OC2=CC=C(C=C2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H27BrO5/c1-27(2,3)23-17-21(28)11-14-24(23)32-18-25(29)33-22-12-9-20(10-13-22)26(30)31-16-15-19-7-5-4-6-8-19/h4-14,17H,15-16,18H2,1-3H3