4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid

Systemtic Name: 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid Openeye Name: 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid CAS Name: 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid IUPAC Name: 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid Traditional Name: 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylic acid Formula: C9H5N3O4S MolecularWeight: 251.2187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NSN=C2C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NSN=C2C(=O)O

InChI

InChI=1S/C9H5N3O4S/c13-9(14)8-7(10-17-11-8)5-2-1-3-6(4-5)12(15)16/h1-4H,(H,13,14)