3-bromanyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzenesulfonamide Openeye Name: 3-bromo-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzenesulfonamide CAS Name: 3-bromo-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]benzenesulfonamide Traditional Name: 3-bromo-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzenesulfonamide Formula: C14H14BrN3O5S MolecularWeight: 416.24706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC(=CC(=C1)Br)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO

InChI

InChI=1S/C14H14BrN3O5S/c15-10-2-1-3-12(8-10)24(22,23)17-14-9-11(18(20)21)4-5-13(14)16-6-7-19/h1-5,8-9,16-17,19H,6-7H2