4-[[4-(nitrooxymethyl)phenyl]carbonylsulfamoyl]benzoic acid

Systemtic Name: 4-[[4-(nitrooxymethyl)phenyl]carbonylsulfamoyl]benzoic acid Openeye Name: 4-[[4-(nitrooxymethyl)benzoyl]sulfamoyl]benzoic acid CAS Name: 4-[[[4-(nitrooxymethyl)phenyl]-oxomethyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[4-(nitrooxymethyl)benzoyl]sulfamoyl]benzoic acid Traditional Name: 4-[[4-(nitrooxymethyl)benzoyl]sulfamoyl]benzoic acid Formula: C15H12N2O8S MolecularWeight: 380.32938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CO[N+](=O)[O-])C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CO[N+](=O)[O-])C(=O)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H12N2O8S/c18-14(11-3-1-10(2-4-11)9-25-17(21)22)16-26(23,24)13-7-5-12(6-8-13)15(19)20/h1-8H,9H2,(H,16,18)(H,19,20)