4-[2-(3-chlorophenyl)-4-(trifluoromethyl)imidazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[2-(3-chlorophenyl)-4-(trifluoromethyl)imidazol-1-yl]benzenesulfonic acid Openeye Name: 4-[2-(3-chlorophenyl)-4-(trifluoromethyl)imidazol-1-yl]benzenesulfonic acid CAS Name: 4-[2-(3-chlorophenyl)-4-(trifluoromethyl)-1-imidazolyl]benzenesulfonic acid IUPAC Name: 4-[2-(3-chlorophenyl)-4-(trifluoromethyl)imidazol-1-yl]benzenesulfonic acid Traditional Name: 4-[2-(3-chlorophenyl)-4-(trifluoromethyl)imidazol-1-yl]besylic acid Formula: C16H10ClF3N2O3S MolecularWeight: 402.77541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NC(=CN2C3=CC=C(C=C3)S(=O)(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NC(=CN2C3=CC=C(C=C3)S(=O)(=O)O)C(F)(F)F

InChI

InChI=1S/C16H10ClF3N2O3S/c17-11-3-1-2-10(8-11)15-21-14(16(18,19)20)9-22(15)12-4-6-13(7-5-12)26(23,24)25/h1-9H,(H,23,24,25)