methyl 3-nitro-5-[[4-(phenethylsulfamoyl)phenyl]carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[[4-(phenethylsulfamoyl)phenyl]carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[[4-(phenethylsulfamoyl)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[4-(phenethylsulfamoyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[[4-(phenethylsulfamoyl)phenyl]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[4-(phenethylsulfamoyl)phenyl]carbamoyl]benzoic acid methyl ester Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7S/c1-33-23(28)18-13-17(14-20(15-18)26(29)30)22(27)25-19-7-9-21(10-8-19)34(31,32)24-12-11-16-5-3-2-4-6-16/h2-10,13-15,24H,11-12H2,1H3,(H,25,27)