4-tert-butyl-3-iodanyl-benzoic acid

Systemtic Name: 4-tert-butyl-3-iodanyl-benzoic acid Openeye Name: 4-tert-butyl-3-iodo-benzoic acid CAS Name: 4-tert-butyl-3-iodobenzoic acid IUPAC Name: 4-tert-butyl-3-iodobenzoic acid Traditional Name: 4-tert-butyl-3-iodo-benzoic acid Formula: C11H13IO2 MolecularWeight: 304.12419

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)O)I

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)O)I

InChI

InChI=1S/C11H13IO2/c1-11(2,3)8-5-4-7(10(13)14)6-9(8)12/h4-6H,1-3H3,(H,13,14)