4-[2-[(5-nitro-2-oxidanyl-phenyl)methylsulfonylamino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(5-nitro-2-oxidanyl-phenyl)methylsulfonylamino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[(2-hydroxy-5-nitro-phenyl)methylsulfonylamino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(2-hydroxy-5-nitrophenyl)methylsulfonylamino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(2-hydroxy-5-nitrophenyl)methylsulfonylamino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[(2-hydroxy-5-nitro-benzyl)sulfonylamino]ethyl]benzenesulfonamide Formula: C15H17N3O7S2 MolecularWeight: 415.44138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNS(=O)(=O)CC2=C(C=CC(=C2)[N+](=O)[O-])O)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNS(=O)(=O)CC2=C(C=CC(=C2)[N+](=O)[O-])O)S(=O)(=O)N

InChI

InChI=1S/C15H17N3O7S2/c16-27(24,25)14-4-1-11(2-5-14)7-8-17-26(22,23)10-12-9-13(18(20)21)3-6-15(12)19/h1-6,9,17,19H,7-8,10H2,(H2,16,24,25)