N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-4-bromanyl-benzenesulfonamide

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-4-bromanyl-benzenesulfonamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropoxy)phenyl]butyl]-4-bromo-benzenesulfonamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-4-bromobenzenesulfonamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-4-bromobenzenesulfonamide Traditional Name: 4-bromo-N-[4-(2,4-ditert-amyloxyphenyl)butyl]benzenesulfonamide Formula: C26H38BrNO4S MolecularWeight: 540.55322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNS(=O)(=O)C2=CC=C(C=C2)Br)OC(C)(C)CC

Isomeric SMILES

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNS(=O)(=O)C2=CC=C(C=C2)Br)OC(C)(C)CC

InChI

InChI=1S/C26H38BrNO4S/c1-7-25(3,4)31-22-15-12-20(24(19-22)32-26(5,6)8-2)11-9-10-18-28-33(29,30)23-16-13-21(27)14-17-23/h12-17,19,28H,7-11,18H2,1-6H3