[(1S)-2-[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[4-(diethylsulfamoyl)-2-nitro-anilino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[4-(diethylsulfamoyl)-2-nitroanilino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[4-(diethylsulfamoyl)-2-nitroanilino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[4-(diethylsulfamoyl)-2-nitro-anilino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C20H29N4O4S+ MolecularWeight: 421.53366

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CC=C2)[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC[C@H](C2=CC=CC=C2)[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O4S/c1-5-23(6-2)29(27,28)17-12-13-18(19(14-17)24(25)26)21-15-20(22(3)4)16-10-8-7-9-11-16/h7-14,20-21H,5-6,15H2,1-4H3/p+1/t20-/m1/s1