3-[[4-(tert-butylsulfamoyl)-2-nitro-phenyl]amino]propyl-cyclohexyl-azanium

Systemtic Name: 3-[[4-(tert-butylsulfamoyl)-2-nitro-phenyl]amino]propyl-cyclohexyl-azanium Openeye Name: 3-[4-(tert-butylsulfamoyl)-2-nitro-anilino]propyl-cyclohexyl-ammonium CAS Name: 3-[4-(tert-butylsulfamoyl)-2-nitroanilino]propyl-cyclohexylammonium IUPAC Name: 3-[4-(tert-butylsulfamoyl)-2-nitroanilino]propyl-cyclohexylazanium Traditional Name: 3-[4-(tert-butylsulfamoyl)-2-nitro-anilino]propyl-cyclohexyl-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)NCCC[NH2+]C2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCC[NH2+]C2CCCCC2)[N+](=O)[O-]

InChI

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