methyl 3-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 3-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfamoyl]benzoate Openeye Name: methyl 3-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfamoyl]benzoate CAS Name: 3-[[2-(2-hydroxyethylamino)-5-nitrophenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-hydroxyethylamino)-5-nitrophenyl]sulfamoyl]benzoate Traditional Name: 3-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]sulfamoyl]benzoic acid methyl ester Formula: C16H17N3O7S MolecularWeight: 395.38708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O7S/c1-26-16(21)11-3-2-4-13(9-11)27(24,25)18-15-10-12(19(22)23)5-6-14(15)17-7-8-20/h2-6,9-10,17-18,20H,7-8H2,1H3