tert-butyl 2-(5-iodanyl-2-nitro-phenyl)ethanoate

Systemtic Name: tert-butyl 2-(5-iodanyl-2-nitro-phenyl)ethanoate Openeye Name: tert-butyl 2-(5-iodo-2-nitro-phenyl)acetate CAS Name: 2-(5-iodo-2-nitrophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(5-iodo-2-nitrophenyl)acetate Traditional Name: 2-(5-iodo-2-nitro-phenyl)acetic acid tert-butyl ester Formula: C12H14INO4 MolecularWeight: 363.14833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1=C(C=CC(=C1)I)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CC1=C(C=CC(=C1)I)[N+](=O)[O-]

InChI

InChI=1S/C12H14INO4/c1-12(2,3)18-11(15)7-8-6-9(13)4-5-10(8)14(16)17/h4-6H,7H2,1-3H3