4-[2-(4-bromanylphenoxy)ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(4-bromanylphenoxy)ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(4-bromophenoxy)ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(4-bromophenoxy)ethoxy]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(4-bromophenoxy)ethoxy]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(4-bromophenoxy)ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C18H21BrN2O6S MolecularWeight: 473.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H21BrN2O6S/c1-3-20(4-2)28(24,25)16-9-10-18(17(13-16)21(22)23)27-12-11-26-15-7-5-14(19)6-8-15/h5-10,13H,3-4,11-12H2,1-2H3