ethyl 2-[2-(4-iodanylbutyl)-3-nitro-phenyl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[2-(4-iodanylbutyl)-3-nitro-phenyl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[2-(4-iodobutyl)-3-nitro-phenyl]-2-oxo-acetate CAS Name: 2-[2-(4-iodobutyl)-3-nitrophenyl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-iodobutyl)-3-nitrophenyl]-2-oxoacetate Traditional Name: 2-[2-(4-iodobutyl)-3-nitro-phenyl]-2-keto-acetic acid ethyl ester Formula: C14H16INO5 MolecularWeight: 405.18501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=C(C(=CC=C1)[N+](=O)[O-])CCCCI

Isomeric SMILES

CCOC(=O)C(=O)C1=C(C(=CC=C1)[N+](=O)[O-])CCCCI

InChI

InChI=1S/C14H16INO5/c1-2-21-14(18)13(17)11-7-5-8-12(16(19)20)10(11)6-3-4-9-15/h5,7-8H,2-4,6,9H2,1H3