1-[(E)-6-(dioxidanyl)-6-methyl-hept-4-en-2-yl]-2-nitro-imidazole

Systemtic Name: 1-[(E)-6-(dioxidanyl)-6-methyl-hept-4-en-2-yl]-2-nitro-imidazole Openeye Name: 1-[(E)-5-hydroperoxy-1,5-dimethyl-hex-3-enyl]-2-nitro-imidazole CAS Name: 1-[(E)-6-hydroperoxy-6-methylhept-4-en-2-yl]-2-nitroimidazole IUPAC Name: 1-[(E)-6-hydroperoxy-6-methylhept-4-en-2-yl]-2-nitroimidazole Traditional Name: 1-[(E)-5-hydroperoxy-1,5-dimethyl-hex-3-enyl]-2-nitro-imidazole Formula: C11H17N3O4 MolecularWeight: 255.27038

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC(C)(C)OO)N1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CC(C/C=C/C(C)(C)OO)N1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C11H17N3O4/c1-9(5-4-6-11(2,3)18-17)13-8-7-12-10(13)14(15)16/h4,6-9,17H,5H2,1-3H3/b6-4+