4-bromanyl-N-[2-(hydroxymethyl)-4-methyl-phenyl]-2-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(hydroxymethyl)-4-methyl-phenyl]-2-(trifluoromethyloxy)benzenesulfonamide Openeye Name: 4-bromo-N-[2-(hydroxymethyl)-4-methyl-phenyl]-2-(trifluoromethoxy)benzenesulfonamide CAS Name: 4-bromo-N-[2-(hydroxymethyl)-4-methylphenyl]-2-(trifluoromethoxy)benzenesulfonamide IUPAC Name: 4-bromo-N-[2-(hydroxymethyl)-4-methylphenyl]-2-(trifluoromethoxy)benzenesulfonamide Traditional Name: 4-bromo-N-(4-methyl-2-methylol-phenyl)-2-(trifluoromethoxy)benzenesulfonamide Formula: C15H13BrF3NO4S MolecularWeight: 440.23223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)OC(F)(F)F)CO

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)OC(F)(F)F)CO

InChI

InChI=1S/C15H13BrF3NO4S/c1-9-2-4-12(10(6-9)8-21)20-25(22,23)14-5-3-11(16)7-13(14)24-15(17,18)19/h2-7,20-21H,8H2,1H3