ethyl 4-[[3-(dimethylsulfamoyl)phenyl]methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[[3-(dimethylsulfamoyl)phenyl]methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-[[3-(dimethylsulfamoyl)phenyl]methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[[3-(dimethylsulfamoyl)phenyl]methoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(dimethylsulfamoyl)phenyl]methoxy]-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-[3-(dimethylsulfamoyl)benzyl]oxy-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C21H22N4O7S MolecularWeight: 474.48698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC2=CC(=CC=C2)S(=O)(=O)N(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC2=CC(=CC=C2)S(=O)(=O)N(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O7S/c1-4-31-21(26)20-19(13-24(22-20)16-8-10-17(11-9-16)25(27)28)32-14-15-6-5-7-18(12-15)33(29,30)23(2)3/h5-13H,4,14H2,1-3H3