3-tert-butyl-4-iodanyl-5-phenyl-1,2-oxazole

Systemtic Name: 3-tert-butyl-4-iodanyl-5-phenyl-1,2-oxazole Openeye Name: 3-tert-butyl-4-iodo-5-phenyl-isoxazole CAS Name: 3-tert-butyl-4-iodo-5-phenylisoxazole IUPAC Name: 3-tert-butyl-4-iodo-5-phenyl-1,2-oxazole Traditional Name: 3-tert-butyl-4-iodo-5-phenyl-isoxazole Formula: C13H14INO MolecularWeight: 327.16083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1I)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=NOC(=C1I)C2=CC=CC=C2

InChI

InChI=1S/C13H14INO/c1-13(2,3)12-10(14)11(16-15-12)9-7-5-4-6-8-9/h4-8H,1-3H3