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

Systemtic Name: (2-tert-butyl-4-methyl-phenyl) 3-iodanyl-4-methoxy-benzoate Openeye Name: (2-tert-butyl-4-methyl-phenyl) 3-iodo-4-methoxy-benzoate CAS Name: 3-iodo-4-methoxybenzoic acid (2-tert-butyl-4-methylphenyl) ester IUPAC Name: (2-tert-butyl-4-methylphenyl) 3-iodo-4-methoxybenzoate Traditional Name: 3-iodo-4-methoxy-benzoic acid (2-tert-butyl-4-methyl-phenyl) ester Formula: C19H21IO3 MolecularWeight: 424.27271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC)I)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC)I)C(C)(C)C

InChI

InChI=1S/C19H21IO3/c1-12-6-8-16(14(10-12)19(2,3)4)23-18(21)13-7-9-17(22-5)15(20)11-13/h6-11H,1-5H3