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

Systemtic Name: diethyl-[(1S)-2-[(2-nitro-4-sulfamoyl-phenyl)amino]-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-(2-nitro-4-sulfamoyl-anilino)-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-(2-nitro-4-sulfamoylanilino)-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-(2-nitro-4-sulfamoylanilino)-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-(2-nitro-4-sulfamoyl-anilino)-1-phenyl-ethyl]ammonium Formula: C18H25N4O4S+ MolecularWeight: 393.4805

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O4S/c1-3-21(4-2)18(14-8-6-5-7-9-14)13-20-16-11-10-15(27(19,25)26)12-17(16)22(23)24/h5-12,18,20H,3-4,13H2,1-2H3,(H2,19,25,26)/p+1/t18-/m1/s1