(2-bromanyl-4-butan-2-yl-phenyl) 3-iodanyl-4-methyl-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)I)Br

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)I)Br

InChI

InChI=1S/C18H18BrIO2/c1-4-11(2)13-7-8-17(15(19)9-13)22-18(21)14-6-5-12(3)16(20)10-14/h5-11H,4H2,1-3H3