N4-[4-[(4-bromanylphenoxy)methyl]phenyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[4-[(4-bromanylphenoxy)methyl]phenyl]benzene-1,4-disulfonamide Openeye Name: N4-[4-[(4-bromophenoxy)methyl]phenyl]benzene-1,4-disulfonamide CAS Name: N4-[4-[(4-bromophenoxy)methyl]phenyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[4-[(4-bromophenoxy)methyl]phenyl]benzene-1,4-disulfonamide Traditional Name: N'-[4-[(4-bromophenoxy)methyl]phenyl]benzene-1,4-disulfonamide Formula: C19H17BrN2O5S2 MolecularWeight: 497.38268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1COC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H17BrN2O5S2/c20-15-3-7-17(8-4-15)27-13-14-1-5-16(6-2-14)22-29(25,26)19-11-9-18(10-12-19)28(21,23)24/h1-12,22H,13H2,(H2,21,23,24)