(3-methyl-4-nitro-phenyl) 3-(dimethylsulfamoyl)benzoate

Systemtic Name: (3-methyl-4-nitro-phenyl) 3-(dimethylsulfamoyl)benzoate Openeye Name: (3-methyl-4-nitro-phenyl) 3-(dimethylsulfamoyl)benzoate CAS Name: 3-(dimethylsulfamoyl)benzoic acid (3-methyl-4-nitrophenyl) ester IUPAC Name: (3-methyl-4-nitrophenyl) 3-(dimethylsulfamoyl)benzoate Traditional Name: 3-(dimethylsulfamoyl)benzoic acid (3-methyl-4-nitro-phenyl) ester Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O6S/c1-11-9-13(7-8-15(11)18(20)21)24-16(19)12-5-4-6-14(10-12)25(22,23)17(2)3/h4-10H,1-3H3