N-(5-tert-butyl-4-hexadecoxy-2-oxidanyl-phenyl)-2-(2-methoxyethoxy)-5-nitro-benzenesulfonamide

Systemtic Name: N-(5-tert-butyl-4-hexadecoxy-2-oxidanyl-phenyl)-2-(2-methoxyethoxy)-5-nitro-benzenesulfonamide Openeye Name: N-(5-tert-butyl-4-hexadecoxy-2-hydroxy-phenyl)-2-(2-methoxyethoxy)-5-nitro-benzenesulfonamide CAS Name: N-(5-tert-butyl-4-hexadecoxy-2-hydroxyphenyl)-2-(2-methoxyethoxy)-5-nitrobenzenesulfonamide IUPAC Name: N-(5-tert-butyl-4-hexadecoxy-2-hydroxyphenyl)-2-(2-methoxyethoxy)-5-nitrobenzenesulfonamide Traditional Name: N-(5-tert-butyl-4-cetyloxy-2-hydroxy-phenyl)-2-(2-methoxyethoxy)-5-nitro-benzenesulfonamide Formula: C35H56N2O8S MolecularWeight: 664.89274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(C)(C)C)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OCCOC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1C(C)(C)C)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OCCOC)O

InChI

InChI=1S/C35H56N2O8S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-44-33-27-31(38)30(26-29(33)35(2,3)4)36-46(41,42)34-25-28(37(39)40)20-21-32(34)45-24-23-43-5/h20-21,25-27,36,38H,6-19,22-24H2,1-5H3