2-[(4-bromanyl-3-nitro-phenyl)methylamino]ethanesulfonamide

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)methylamino]ethanesulfonamide Openeye Name: 2-[(4-bromo-3-nitro-phenyl)methylamino]ethanesulfonamide CAS Name: 2-[(4-bromo-3-nitrophenyl)methylamino]ethanesulfonamide IUPAC Name: 2-[(4-bromo-3-nitrophenyl)methylamino]ethanesulfonamide Traditional Name: 2-[(4-bromo-3-nitro-benzyl)amino]ethanesulfonamide Formula: C9H12BrN3O4S MolecularWeight: 338.17828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNCCS(=O)(=O)N)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1CNCCS(=O)(=O)N)[N+](=O)[O-])Br

InChI

InChI=1S/C9H12BrN3O4S/c10-8-2-1-7(5-9(8)13(14)15)6-12-3-4-18(11,16)17/h1-2,5,12H,3-4,6H2,(H2,11,16,17)