3-[2-(3-bromanylphenoxy)ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide Openeye Name: 3-[2-(3-bromophenoxy)ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide CAS Name: 3-[2-(3-bromophenoxy)ethoxy]-N,N-diethyl-5-benzotriazolesulfonamide IUPAC Name: 3-[2-(3-bromophenoxy)ethoxy]-N,N-diethylbenzotriazole-5-sulfonamide Traditional Name: 3-[2-(3-bromophenoxy)ethoxy]-N,N-diethyl-benzotriazole-5-sulfonamide Formula: C18H21BrN4O4S MolecularWeight: 469.35274

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H21BrN4O4S/c1-3-22(4-2)28(24,25)16-8-9-17-18(13-16)23(21-20-17)27-11-10-26-15-7-5-6-14(19)12-15/h5-9,12-13H,3-4,10-11H2,1-2H3