4-[4-chloranyl-5-(4-methylphenyl)imidazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[4-chloranyl-5-(4-methylphenyl)imidazol-1-yl]benzenesulfonic acid Openeye Name: 4-[4-chloro-5-(p-tolyl)imidazol-1-yl]benzenesulfonic acid CAS Name: 4-[4-chloro-5-(4-methylphenyl)-1-imidazolyl]benzenesulfonic acid IUPAC Name: 4-[4-chloro-5-(4-methylphenyl)imidazol-1-yl]benzenesulfonic acid Traditional Name: 4-[4-chloro-5-(p-tolyl)imidazol-1-yl]besylic acid Formula: C16H13ClN2O3S MolecularWeight: 348.80402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=CN2C3=CC=C(C=C3)S(=O)(=O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=CN2C3=CC=C(C=C3)S(=O)(=O)O)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-11-2-4-12(5-3-11)15-16(17)18-10-19(15)13-6-8-14(9-7-13)23(20,21)22/h2-10H,1H3,(H,20,21,22)