N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide

Systemtic Name: N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Openeye Name: N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide CAS Name: N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide IUPAC Name: N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Traditional Name: N,2-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Formula: C16H19N3O6S2 MolecularWeight: 413.46856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)C(C)C2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)C(C)C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H19N3O6S2/c1-11-4-7-14(19(20)21)10-16(11)27(24,25)18(3)12(2)13-5-8-15(9-6-13)26(17,22)23/h4-10,12H,1-3H3,(H2,17,22,23)