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

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-nitro-benzenesulfonamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropoxy)phenyl]butyl]-2-nitro-benzenesulfonamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yloxy)phenyl]butyl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-(2,4-ditert-amyloxyphenyl)butyl]-2-nitro-benzenesulfonamide Formula: C26H38N2O6S MolecularWeight: 506.65472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])OC(C)(C)CC

Isomeric SMILES

CCC(C)(C)OC1=CC(=C(C=C1)CCCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])OC(C)(C)CC

InChI

InChI=1S/C26H38N2O6S/c1-7-25(3,4)33-21-17-16-20(23(19-21)34-26(5,6)8-2)13-11-12-18-27-35(31,32)24-15-10-9-14-22(24)28(29)30/h9-10,14-17,19,27H,7-8,11-13,18H2,1-6H3