1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethyloxy)phenyl]sulfonyl-1,4-diazepane

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethyloxy)phenyl]sulfonyl-1,4-diazepane Openeye Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane CAS Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane IUPAC Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane Traditional Name: 1-(4-fluorophenyl)sulfonyl-4-[2-(trifluoromethoxy)phenyl]sulfonyl-1,4-diazepane Formula: C18H18F4N2O5S2 MolecularWeight: 482.469533

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC=C2OC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CC=C2OC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18F4N2O5S2/c19-14-6-8-15(9-7-14)30(25,26)23-10-3-11-24(13-12-23)31(27,28)17-5-2-1-4-16(17)29-18(20,21)22/h1-2,4-9H,3,10-13H2