N4,N4-diethyl-N1-[(3-fluorophenyl)methyl]-N1-methyl-benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-[(3-fluorophenyl)methyl]-N1-methyl-benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-[(3-fluorophenyl)methyl]-N1-methyl-benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-[(3-fluorophenyl)methyl]-N1-methylbenzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-[(3-fluorophenyl)methyl]-1-N-methylbenzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-(3-fluorobenzyl)-N-methyl-benzene-1,4-disulfonamide Formula: C18H23FN2O4S2 MolecularWeight: 414.514623

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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(=CC=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C18H23FN2O4S2/c1-4-21(5-2)27(24,25)18-11-9-17(10-12-18)26(22,23)20(3)14-15-7-6-8-16(19)13-15/h6-13H,4-5,14H2,1-3H3