(4-bromanyl-2-tert-butyl-phenyl) 4-(2-methylpropoxy)benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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