ethyl 3-[[3-(tert-butylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[3-(tert-butylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[3-(tert-butylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[3-(tert-butylsulfamoyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(tert-butylsulfamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[3-(tert-butylsulfamoyl)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=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-5-30-19(25)14-9-13(10-16(11-14)23(26)27)18(24)21-15-7-6-8-17(12-15)31(28,29)22-20(2,3)4/h6-12,22H,5H2,1-4H3,(H,21,24)