3-(4-bromanylbutyl)-1H-imidazol-3-ium ethanoate

Systemtic Name: 3-(4-bromanylbutyl)-1H-imidazol-3-ium ethanoate Openeye Name: 3-(4-bromobutyl)-1H-imidazol-3-ium acetate CAS Name: 3-(4-bromobutyl)-1H-imidazol-3-ium acetate IUPAC Name: 3-(4-bromobutyl)-1H-imidazol-3-ium acetate Traditional Name: 3-(4-bromobutyl)-1H-imidazol-3-ium acetate Formula: C9H15BrN2O2 MolecularWeight: 263.1316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=C[N+](=CN1)CCCCBr

Isomeric SMILES

CC(=O)[O-].C1=C[N+](=CN1)CCCCBr

InChI

InChI=1S/C7H11BrN2.C2H4O2/c8-3-1-2-5-10-6-4-9-7-10;1-2(3)4/h4,6-7H,1-3,5H2;1H3,(H,3,4)