N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-4-hydroxy-3-nitro-benzenesulfonamide Formula: C17H21N3O8S2 MolecularWeight: 459.49394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O8S2/c1-4-19(5-2)30(26,27)13-7-9-17(28-3)14(10-13)18-29(24,25)12-6-8-16(21)15(11-12)20(22)23/h6-11,18,21H,4-5H2,1-3H3