1-(3-tert-butyl-4-oxidanyl-phenyl)-2-iodanyl-ethanone

Systemtic Name: 1-(3-tert-butyl-4-oxidanyl-phenyl)-2-iodanyl-ethanone Openeye Name: 1-(3-tert-butyl-4-hydroxy-phenyl)-2-iodo-ethanone CAS Name: 1-(3-tert-butyl-4-hydroxyphenyl)-2-iodoethanone IUPAC Name: 1-(3-tert-butyl-4-hydroxyphenyl)-2-iodoethanone Traditional Name: 1-(3-tert-butyl-4-hydroxy-phenyl)-2-iodo-ethanone Formula: C12H15IO2 MolecularWeight: 318.15077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C(=O)CI)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C(=O)CI)O

InChI

InChI=1S/C12H15IO2/c1-12(2,3)9-6-8(11(15)7-13)4-5-10(9)14/h4-6,14H,7H2,1-3H3