1-[4-(trifluoromethyloxy)phenyl]sulfonylazepane

Systemtic Name: 1-[4-(trifluoromethyloxy)phenyl]sulfonylazepane Openeye Name: 1-[4-(trifluoromethoxy)phenyl]sulfonylazepane CAS Name: 1-[4-(trifluoromethoxy)phenyl]sulfonylazepane IUPAC Name: 1-[4-(trifluoromethoxy)phenyl]sulfonylazepane Traditional Name: 1-[4-(trifluoromethoxy)phenyl]sulfonylazepane Formula: C13H16F3NO3S MolecularWeight: 323.33125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C13H16F3NO3S/c14-13(15,16)20-11-5-7-12(8-6-11)21(18,19)17-9-3-1-2-4-10-17/h5-8H,1-4,9-10H2