methyl 3-[[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]amino]benzoate

Systemtic Name: methyl 3-[[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]amino]benzoate Openeye Name: methyl 3-[4-(isopropylsulfamoyl)-2-nitro-anilino]benzoate CAS Name: 3-[2-nitro-4-(propan-2-ylsulfamoyl)anilino]benzoic acid methyl ester IUPAC Name: methyl 3-[2-nitro-4-(propan-2-ylsulfamoyl)anilino]benzoate Traditional Name: 3-[4-(isopropylsulfamoyl)-2-nitro-anilino]benzoic acid methyl ester Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S/c1-11(2)19-27(24,25)14-7-8-15(16(10-14)20(22)23)18-13-6-4-5-12(9-13)17(21)26-3/h4-11,18-19H,1-3H3