2-methyl-4-quinolin-4-yl-imidazole-1-sulfonic acid

Systemtic Name: 2-methyl-4-quinolin-4-yl-imidazole-1-sulfonic acid Openeye Name: 2-methyl-4-(4-quinolyl)imidazole-1-sulfonic acid CAS Name: 2-methyl-4-(4-quinolinyl)-1-imidazolesulfonic acid IUPAC Name: 2-methyl-4-quinolin-4-ylimidazole-1-sulfonic acid Traditional Name: 2-methyl-4-(4-quinolyl)imidazole-1-sulfonic acid Formula: C13H11N3O3S MolecularWeight: 289.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1S(=O)(=O)O)C2=CC=NC3=CC=CC=C23

Isomeric SMILES

CC1=NC(=CN1S(=O)(=O)O)C2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C13H11N3O3S/c1-9-15-13(8-16(9)20(17,18)19)11-6-7-14-12-5-3-2-4-10(11)12/h2-8H,1H3,(H,17,18,19)