(4-bromanyl-2-tert-butyl-phenyl) 3-iodanyl-4-methyl-benzoate

Systemtic Name: (4-bromanyl-2-tert-butyl-phenyl) 3-iodanyl-4-methyl-benzoate Openeye Name: (4-bromo-2-tert-butyl-phenyl) 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid (4-bromo-2-tert-butylphenyl) ester IUPAC Name: (4-bromo-2-tert-butylphenyl) 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid (4-bromo-2-tert-butyl-phenyl) ester Formula: C18H18BrIO2 MolecularWeight: 473.14279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(C)(C)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(C)(C)C)I

InChI

InChI=1S/C18H18BrIO2/c1-11-5-6-12(9-15(11)20)17(21)22-16-8-7-13(19)10-14(16)18(2,3)4/h5-10H,1-4H3