[2,2-dimethyl-3-[[2-nitro-4-(phenylsulfamoyl)phenyl]amino]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[[2-nitro-4-(phenylsulfamoyl)phenyl]amino]propyl]-dimethyl-azanium Openeye Name: [2,2-dimethyl-3-[2-nitro-4-(phenylsulfamoyl)anilino]propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-[2-nitro-4-(phenylsulfamoyl)anilino]propyl]-dimethylammonium IUPAC Name: [2,2-dimethyl-3-[2-nitro-4-(phenylsulfamoyl)anilino]propyl]-dimethylazanium Traditional Name: [2,2-dimethyl-3-[2-nitro-4-(phenylsulfamoyl)anilino]propyl]-dimethyl-ammonium Formula: C19H27N4O4S+ MolecularWeight: 407.50708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2)[N+](=O)[O-])C[NH+](C)C

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2)[N+](=O)[O-])C[NH+](C)C

InChI

InChI=1S/C19H26N4O4S/c1-19(2,14-22(3)4)13-20-17-11-10-16(12-18(17)23(24)25)28(26,27)21-15-8-6-5-7-9-15/h5-12,20-21H,13-14H2,1-4H3/p+1