4-(4-acetamidophenoxy)-3-nitro-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(4-acetamidophenoxy)-3-nitro-5-sulfamoyl-benzoic acid Openeye Name: 4-(4-acetamidophenoxy)-3-nitro-5-sulfamoyl-benzoic acid CAS Name: 4-(4-acetamidophenoxy)-3-nitro-5-sulfamoylbenzoic acid IUPAC Name: 4-(4-acetamidophenoxy)-3-nitro-5-sulfamoylbenzoic acid Traditional Name: 4-(4-acetamidophenoxy)-3-nitro-5-sulfamoyl-benzoic acid Formula: C15H13N3O8S MolecularWeight: 395.34402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O8S/c1-8(19)17-10-2-4-11(5-3-10)26-14-12(18(22)23)6-9(15(20)21)7-13(14)27(16,24)25/h2-7H,1H3,(H,17,19)(H,20,21)(H2,16,24,25)