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

Systemtic Name: 1-methyl-3-[(3-methyl-3-nitro-butan-2-yl)oxymethyl]imidazol-1-ium-2-carboxamide chloride Openeye Name: 1-[(1,2-dimethyl-2-nitro-propoxy)methyl]-3-methyl-imidazol-3-ium-2-carboxamide chloride CAS Name: 1-methyl-3-[(3-methyl-3-nitrobutan-2-yl)oxymethyl]-2-imidazol-1-iumcarboxamide chloride IUPAC Name: 1-methyl-3-[(3-methyl-3-nitrobutan-2-yl)oxymethyl]imidazol-1-ium-2-carboxamide chloride Traditional Name: 1-[(1,2-dimethyl-2-nitro-propoxy)methyl]-3-methyl-imidazol-3-ium-2-carboxamide chloride Formula: C11H19ClN4O4 MolecularWeight: 306.74596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)[N+](=O)[O-])OCN1C=C[N+](=C1C(=O)N)C.[Cl-]

Isomeric SMILES

CC(C(C)(C)[N+](=O)[O-])OCN1C=C[N+](=C1C(=O)N)C.[Cl-]

InChI

InChI=1S/C11H18N4O4.ClH/c1-8(11(2,3)15(17)18)19-7-14-6-5-13(4)10(14)9(12)16;/h5-6,8H,7H2,1-4H3,(H-,12,16);1H