N1-[4-chloranyl-3-(trifluoromethyl)phenyl]-N4,N4-diethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[4-chloranyl-3-(trifluoromethyl)phenyl]-N4,N4-diethyl-benzene-1,4-disulfonamide Openeye Name: N1-[4-chloro-3-(trifluoromethyl)phenyl]-N4,N4-diethyl-benzene-1,4-disulfonamide CAS Name: N1-[4-chloro-3-(trifluoromethyl)phenyl]-N4,N4-diethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-N,4-N-diethylbenzene-1,4-disulfonamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-N',N'-diethyl-benzene-1,4-disulfonamide Formula: C17H18ClF3N2O4S2 MolecularWeight: 470.91403

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H18ClF3N2O4S2/c1-3-23(4-2)29(26,27)14-8-6-13(7-9-14)28(24,25)22-12-5-10-16(18)15(11-12)17(19,20)21/h5-11,22H,3-4H2,1-2H3