3-[4-[(5-nitro-2-oxidanyl-phenyl)sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(5-nitro-2-oxidanyl-phenyl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(2-hydroxy-5-nitro-phenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(2-hydroxy-5-nitrophenyl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-hydroxy-5-nitrophenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(2-hydroxy-5-nitro-phenyl)sulfamoyl]phenyl]propionic acid Formula: C15H14N2O7S MolecularWeight: 366.34586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H14N2O7S/c18-14-7-4-11(17(21)22)9-13(14)16-25(23,24)12-5-1-10(2-6-12)3-8-15(19)20/h1-2,4-7,9,16,18H,3,8H2,(H,19,20)