4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl hydrogen sulfate

Systemtic Name: 4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl hydrogen sulfate Openeye Name: 4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl hydrogen sulfate CAS Name: sulfuric acid 4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl ester IUPAC Name: 4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl hydrogen sulfate Traditional Name: sulfuric acid 4-(2,4-dimethyl-1H-imidazol-3-ium-3-yl)butyl ester Formula: C9H17N2O4S+ MolecularWeight: 249.30728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=[N+]1CCCCOS(=O)(=O)O)C

Isomeric SMILES

CC1=CNC(=[N+]1CCCCOS(=O)(=O)O)C

InChI

InChI=1S/C9H16N2O4S/c1-8-7-10-9(2)11(8)5-3-4-6-15-16(12,13)14/h7H,3-6H2,1-2H3,(H,12,13,14)/p+1