N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C18H17F6NO3S MolecularWeight: 441.387899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C18H17F6NO3S/c1-11-5-12(2)7-15(6-11)28-4-3-25-29(26,27)16-9-13(17(19,20)21)8-14(10-16)18(22,23)24/h5-10,25H,3-4H2,1-2H3