N4-(1,3-benzodioxol-5-ylmethyl)-N1,N1-diethyl-N4-[(4-fluorophenyl)methyl]benzene-1,4-disulfonamide

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1,N1-diethyl-N4-[(4-fluorophenyl)methyl]benzene-1,4-disulfonamide Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1,N1-diethyl-N4-[(4-fluorophenyl)methyl]benzene-1,4-disulfonamide CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1,N1-diethyl-N4-[(4-fluorophenyl)methyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-1-N,1-N-diethyl-4-N-[(4-fluorophenyl)methyl]benzene-1,4-disulfonamide Traditional Name: N,N-diethyl-N'-(4-fluorobenzyl)-N'-piperonyl-benzene-1,4-disulfonamide Formula: C25H27FN2O6S2 MolecularWeight: 534.620083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H27FN2O6S2/c1-3-27(4-2)35(29,30)22-10-12-23(13-11-22)36(31,32)28(16-19-5-8-21(26)9-6-19)17-20-7-14-24-25(15-20)34-18-33-24/h5-15H,3-4,16-18H2,1-2H3