ethyl 3-[[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[5-(dimethylsulfamoyl)-2,3-dimethylanilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[5-(dimethylsulfamoyl)-2,3-dimethyl-phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)N(C)C)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)N(C)C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O7S/c1-6-30-20(25)15-8-14(9-16(10-15)23(26)27)19(24)21-18-11-17(7-12(2)13(18)3)31(28,29)22(4)5/h7-11H,6H2,1-5H3,(H,21,24)