(4-tert-butylphenyl) 3-bromanyl-4-(2-methylpropoxy)benzoate

Systemtic Name: (4-tert-butylphenyl) 3-bromanyl-4-(2-methylpropoxy)benzoate Openeye Name: (4-tert-butylphenyl) 3-bromo-4-isobutoxy-benzoate CAS Name: 3-bromo-4-(2-methylpropoxy)benzoic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 3-bromo-4-(2-methylpropoxy)benzoate Traditional Name: 3-bromo-4-isobutoxy-benzoic acid (4-tert-butylphenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C21H25BrO3/c1-14(2)13-24-19-11-6-15(12-18(19)22)20(23)25-17-9-7-16(8-10-17)21(3,4)5/h6-12,14H,13H2,1-5H3