6-hexyl-5-iodanyl-4-methyl-3-nitro-1H-pyridin-2-one

Systemtic Name: 6-hexyl-5-iodanyl-4-methyl-3-nitro-1H-pyridin-2-one Openeye Name: 6-hexyl-5-iodo-4-methyl-3-nitro-1H-pyridin-2-one CAS Name: 6-hexyl-5-iodo-4-methyl-3-nitro-1H-pyridin-2-one IUPAC Name: 6-hexyl-5-iodo-4-methyl-3-nitro-1H-pyridin-2-one Traditional Name: 6-hexyl-5-iodo-4-methyl-3-nitro-2-pyridone Formula: C12H17IN2O3 MolecularWeight: 364.17945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=O)N1)[N+](=O)[O-])C)I

Isomeric SMILES

CCCCCCC1=C(C(=C(C(=O)N1)[N+](=O)[O-])C)I

InChI

InChI=1S/C12H17IN2O3/c1-3-4-5-6-7-9-10(13)8(2)11(15(17)18)12(16)14-9/h3-7H2,1-2H3,(H,14,16)