N1-[[3,4-bis(fluoranyl)phenyl]methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[[3,4-bis(fluoranyl)phenyl]methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide Openeye Name: N1-[(3,4-difluorophenyl)methyl]-N4,N4-diethyl-N1-methyl-benzene-1,4-disulfonamide CAS Name: N1-[(3,4-difluorophenyl)methyl]-N4,N4-diethyl-N1-methylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[(3,4-difluorophenyl)methyl]-4-N,4-N-diethyl-1-N-methylbenzene-1,4-disulfonamide Traditional Name: N-(3,4-difluorobenzyl)-N',N'-diethyl-N-methyl-benzene-1,4-disulfonamide Formula: C18H22F2N2O4S2 MolecularWeight: 432.505086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)F)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C18H22F2N2O4S2/c1-4-22(5-2)28(25,26)16-9-7-15(8-10-16)27(23,24)21(3)13-14-6-11-17(19)18(20)12-14/h6-12H,4-5,13H2,1-3H3