tert-butyl 4-iodanyl-3-nitro-benzoate

Systemtic Name: tert-butyl 4-iodanyl-3-nitro-benzoate Openeye Name: tert-butyl 4-iodo-3-nitro-benzoate CAS Name: 4-iodo-3-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-iodo-3-nitrobenzoate Traditional Name: 4-iodo-3-nitro-benzoic acid tert-butyl ester Formula: C11H12INO4 MolecularWeight: 349.12175

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12INO4/c1-11(2,3)17-10(14)7-4-5-8(12)9(6-7)13(15)16/h4-6H,1-3H3