3-[2-(4-bromanyl-2-nitro-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide

Systemtic Name: 3-[2-(4-bromanyl-2-nitro-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide Openeye Name: 3-[2-(4-bromo-2-nitro-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide CAS Name: 3-[2-(4-bromo-2-nitrophenyl)ethyl]-5-cyano-2-methoxybenzenesulfonamide IUPAC Name: 3-[2-(4-bromo-2-nitrophenyl)ethyl]-5-cyano-2-methoxybenzenesulfonamide Traditional Name: 3-[2-(4-bromo-2-nitro-phenyl)ethyl]-5-cyano-2-methoxy-benzenesulfonamide Formula: C16H14BrN3O5S MolecularWeight: 440.26846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1S(=O)(=O)N)C#N)CCC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1S(=O)(=O)N)C#N)CCC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrN3O5S/c1-25-16-12(6-10(9-18)7-15(16)26(19,23)24)3-2-11-4-5-13(17)8-14(11)20(21)22/h4-8H,2-3H2,1H3,(H2,19,23,24)