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

Systemtic Name: N1,N1,N4-triethyl-N4-[(3-fluoranyl-4-methoxy-phenyl)methyl]benzene-1,4-disulfonamide Openeye Name: N1,N1,N4-triethyl-N4-[(3-fluoro-4-methoxy-phenyl)methyl]benzene-1,4-disulfonamide CAS Name: N1,N1,N4-triethyl-N4-[(3-fluoro-4-methoxyphenyl)methyl]benzene-1,4-disulfonamide IUPAC Name: 1-N,1-N,4-N-triethyl-4-N-[(3-fluoro-4-methoxyphenyl)methyl]benzene-1,4-disulfonamide Traditional Name: N,N,N'-triethyl-N'-(3-fluoro-4-methoxy-benzyl)benzene-1,4-disulfonamide Formula: C20H27FN2O5S2 MolecularWeight: 458.567183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27FN2O5S2/c1-5-22(6-2)29(24,25)17-9-11-18(12-10-17)30(26,27)23(7-3)15-16-8-13-20(28-4)19(21)14-16/h8-14H,5-7,15H2,1-4H3