hydrogen sulfate; (2S)-1-(3-methylimidazol-3-ium-1-yl)propan-2-ol

Systemtic Name: hydrogen sulfate; (2S)-1-(3-methylimidazol-3-ium-1-yl)propan-2-ol Openeye Name: hydrogen sulfate; (2S)-1-(3-methylimidazol-3-ium-1-yl)propan-2-ol CAS Name: hydrogen sulfate; (2S)-1-(3-methyl-1-imidazol-3-iumyl)-2-propanol IUPAC Name: hydrogen sulfate; (2S)-1-(3-methylimidazol-3-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(3-methylimidazol-3-ium-1-yl)propan-2-ol bisulfate Formula: C7H14N2O5S MolecularWeight: 238.26146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C[N+](=C1)C)O.OS(=O)(=O)[O-]

Isomeric SMILES

C[C@@H](CN1C=C[N+](=C1)C)O.OS(=O)(=O)[O-]

InChI

InChI=1S/C7H13N2O.H2O4S/c1-7(10)5-9-4-3-8(2)6-9;1-5(2,3)4/h3-4,6-7,10H,5H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1/t7-;/m0./s1