2-[(3-ethyl-2-methyl-2H-imidazol-1-yl)methyl]benzenesulfonic acid

Systemtic Name: 2-[(3-ethyl-2-methyl-2H-imidazol-1-yl)methyl]benzenesulfonic acid Openeye Name: 2-[(3-ethyl-2-methyl-2H-imidazol-1-yl)methyl]benzenesulfonic acid CAS Name: 2-[(3-ethyl-2-methyl-2H-imidazol-1-yl)methyl]benzenesulfonic acid IUPAC Name: 2-[(3-ethyl-2-methyl-2H-imidazol-1-yl)methyl]benzenesulfonic acid Traditional Name: 2-[(3-ethyl-2-methyl-4-imidazolin-1-yl)methyl]besylic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN(C1C)CC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CCN1C=CN(C1C)CC2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C13H18N2O3S/c1-3-14-8-9-15(11(14)2)10-12-6-4-5-7-13(12)19(16,17)18/h4-9,11H,3,10H2,1-2H3,(H,16,17,18)