[1-[[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: [1-[[4-(diethylsulfamoyl)-2-nitro-anilino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[4-(diethylsulfamoyl)-2-nitroanilino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[4-(diethylsulfamoyl)-2-nitroanilino]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[4-(diethylsulfamoyl)-2-nitro-anilino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C19H33N4O4S+ MolecularWeight: 413.55472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2(CCCCC2)[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H32N4O4S/c1-5-22(6-2)28(26,27)16-10-11-17(18(14-16)23(24)25)20-15-19(21(3)4)12-8-7-9-13-19/h10-11,14,20H,5-9,12-13,15H2,1-4H3/p+1