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

Systemtic Name: [(1S)-1-(4-methoxyphenyl)-2-[(2-nitro-4-sulfamoyl-phenyl)amino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-methoxyphenyl)-2-(2-nitro-4-sulfamoyl-anilino)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)-2-(2-nitro-4-sulfamoylanilino)ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)-2-(2-nitro-4-sulfamoylanilino)ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-methoxyphenyl)-2-(2-nitro-4-sulfamoyl-anilino)ethyl]-dimethyl-ammonium Formula: C17H23N4O5S+ MolecularWeight: 395.45332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O5S/c1-20(2)17(12-4-6-13(26-3)7-5-12)11-19-15-9-8-14(27(18,24)25)10-16(15)21(22)23/h4-10,17,19H,11H2,1-3H3,(H2,18,24,25)/p+1/t17-/m1/s1