N-[4-(butylsulfamoyl)-2-nitro-phenyl]-1-oxidanyl-naphthalene-2-sulfonamide

Systemtic Name: N-[4-(butylsulfamoyl)-2-nitro-phenyl]-1-oxidanyl-naphthalene-2-sulfonamide Openeye Name: N-[4-(butylsulfamoyl)-2-nitro-phenyl]-1-hydroxy-naphthalene-2-sulfonamide CAS Name: N-[4-(butylsulfamoyl)-2-nitrophenyl]-1-hydroxy-2-naphthalenesulfonamide IUPAC Name: N-[4-(butylsulfamoyl)-2-nitrophenyl]-1-hydroxynaphthalene-2-sulfonamide Traditional Name: N-[4-(butylsulfamoyl)-2-nitro-phenyl]-1-hydroxy-naphthalene-2-sulfonamide Formula: C20H21N3O7S2 MolecularWeight: 479.52664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2=C(C3=CC=CC=C3C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2=C(C3=CC=CC=C3C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O7S2/c1-2-3-12-21-31(27,28)15-9-10-17(18(13-15)23(25)26)22-32(29,30)19-11-8-14-6-4-5-7-16(14)20(19)24/h4-11,13,21-22,24H,2-3,12H2,1H3