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

Systemtic Name: [(2R)-1-[[4-(tert-butylsulfamoyl)-2-nitro-phenyl]amino]-4-methyl-pentan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-[[4-(tert-butylsulfamoyl)-2-nitro-anilino]methyl]-3-methyl-butyl]-dimethyl-ammonium CAS Name: [(2R)-1-[4-(tert-butylsulfamoyl)-2-nitroanilino]-4-methylpentan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[4-(tert-butylsulfamoyl)-2-nitroanilino]-4-methylpentan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-[[4-(tert-butylsulfamoyl)-2-nitro-anilino]methyl]-3-methyl-butyl]-dimethyl-ammonium Formula: C18H33N4O4S+ MolecularWeight: 401.54402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@H](CNC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-])[NH+](C)C

InChI

InChI=1S/C18H32N4O4S/c1-13(2)10-14(21(6)7)12-19-16-9-8-15(11-17(16)22(23)24)27(25,26)20-18(3,4)5/h8-9,11,13-14,19-20H,10,12H2,1-7H3/p+1/t14-/m1/s1