N-[3-(cyclopropylamino)propyl]-4-fluoranyl-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-(cyclopropylamino)propyl]-4-fluoranyl-2-nitro-benzenesulfonamide Openeye Name: N-[3-(cyclopropylamino)propyl]-4-fluoro-2-nitro-benzenesulfonamide CAS Name: N-[3-(cyclopropylamino)propyl]-4-fluoro-2-nitrobenzenesulfonamide IUPAC Name: N-[3-(cyclopropylamino)propyl]-4-fluoro-2-nitrobenzenesulfonamide Traditional Name: N-[3-(cyclopropylamino)propyl]-4-fluoro-2-nitro-benzenesulfonamide Formula: C12H16FN3O4S MolecularWeight: 317.336543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCCCNS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1CC1NCCCNS(=O)(=O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C12H16FN3O4S/c13-9-2-5-12(11(8-9)16(17)18)21(19,20)15-7-1-6-14-10-3-4-10/h2,5,8,10,14-15H,1,3-4,6-7H2