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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O4S/c1-18(2,3)21-28(26,27)15-9-10-16(17(13-15)23(24)25)20-14-19(22(4)5)11-7-6-8-12-19/h9-10,13,20-21H,6-8,11-12,14H2,1-5H3/p+1