1-ethyl-2-[(4-iodanyl-2-nitro-phenoxy)methyl]-5-nitro-imidazole

Systemtic Name: 1-ethyl-2-[(4-iodanyl-2-nitro-phenoxy)methyl]-5-nitro-imidazole Openeye Name: 1-ethyl-2-[(4-iodo-2-nitro-phenoxy)methyl]-5-nitro-imidazole CAS Name: 1-ethyl-2-[(4-iodo-2-nitrophenoxy)methyl]-5-nitroimidazole IUPAC Name: 1-ethyl-2-[(4-iodo-2-nitrophenoxy)methyl]-5-nitroimidazole Traditional Name: 1-ethyl-2-[(4-iodo-2-nitro-phenoxy)methyl]-5-nitro-imidazole Formula: C12H11IN4O5 MolecularWeight: 418.14401

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1COC2=C(C=C(C=C2)I)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CN=C1COC2=C(C=C(C=C2)I)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H11IN4O5/c1-2-15-11(14-6-12(15)17(20)21)7-22-10-4-3-8(13)5-9(10)16(18)19/h3-6H,2,7H2,1H3