1-tert-butyl-3-iodanyl-2-nitro-benzene; 4-tert-butyl-1-iodanyl-2-nitro-benzene

Systemtic Name: 1-tert-butyl-3-iodanyl-2-nitro-benzene; 4-tert-butyl-1-iodanyl-2-nitro-benzene Openeye Name: 1-tert-butyl-3-iodo-2-nitro-benzene; 4-tert-butyl-1-iodo-2-nitro-benzene CAS Name: 1-tert-butyl-3-iodo-2-nitrobenzene; 4-tert-butyl-1-iodo-2-nitrobenzene IUPAC Name: 1-tert-butyl-3-iodo-2-nitrobenzene; 4-tert-butyl-1-iodo-2-nitrobenzene Traditional Name: 1-tert-butyl-3-iodo-2-nitro-benzene; 4-tert-butyl-1-iodo-2-nitro-benzene Formula: C20H24I2N2O4 MolecularWeight: 610.2245

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)I)[N+](=O)[O-].CC(C)(C)C1=C(C(=CC=C1)I)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)I)[N+](=O)[O-].CC(C)(C)C1=C(C(=CC=C1)I)[N+](=O)[O-]

InChI

InChI=1S/2C10H12INO2/c1-10(2,3)7-4-5-8(11)9(6-7)12(13)14;1-10(2,3)7-5-4-6-8(11)9(7)12(13)14/h2*4-6H,1-3H3