3,4-dimethoxy-N-[3-[(4-nitrophenyl)amino]propyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[3-[(4-nitrophenyl)amino]propyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[3-(4-nitroanilino)propyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[3-(4-nitroanilino)propyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[3-(4-nitroanilino)propyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[3-(4-nitroanilino)propyl]benzenesulfonamide Formula: C17H21N3O6S MolecularWeight: 395.43014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCNC2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCNC2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H21N3O6S/c1-25-16-9-8-15(12-17(16)26-2)27(23,24)19-11-3-10-18-13-4-6-14(7-5-13)20(21)22/h4-9,12,18-19H,3,10-11H2,1-2H3