1,2-dimethyl-3-[(3-methyl-3-nitro-butan-2-yl)oxymethyl]imidazol-1-ium chloride

Systemtic Name: 1,2-dimethyl-3-[(3-methyl-3-nitro-butan-2-yl)oxymethyl]imidazol-1-ium chloride Openeye Name: 1-[(1,2-dimethyl-2-nitro-propoxy)methyl]-2,3-dimethyl-imidazol-3-ium chloride CAS Name: 1,2-dimethyl-3-[(3-methyl-3-nitrobutan-2-yl)oxymethyl]imidazol-1-ium chloride IUPAC Name: 1,2-dimethyl-3-[(3-methyl-3-nitrobutan-2-yl)oxymethyl]imidazol-1-ium chloride Traditional Name: 1-[(1,2-dimethyl-2-nitro-propoxy)methyl]-2,3-dimethyl-imidazol-3-ium chloride Formula: C11H20ClN3O3 MolecularWeight: 277.7478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1COC(C)C(C)(C)[N+](=O)[O-])C.[Cl-]

Isomeric SMILES

CC1=[N+](C=CN1COC(C)C(C)(C)[N+](=O)[O-])C.[Cl-]

InChI

InChI=1S/C11H20N3O3.ClH/c1-9(11(3,4)14(15)16)17-8-13-7-6-12(5)10(13)2;/h6-7,9H,8H2,1-5H3;1H/q+1;/p-1