4-(5-nitro-2-oxidanyl-phenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid

Systemtic Name: 4-(5-nitro-2-oxidanyl-phenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid Openeye Name: 4-(2-hydroxy-5-nitro-phenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid CAS Name: 4-(2-hydroxy-5-nitrophenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid IUPAC Name: 4-(2-hydroxy-5-nitrophenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid Traditional Name: 4-(2-hydroxy-5-nitro-phenyl)-1$l^{4}-thia-2,5-diazacyclopenta-1,3,5-triene-3-carboxylic acid Formula: C9H5N3O5S MolecularWeight: 267.2181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C2=C(N=S=N2)C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C2=C(N=S=N2)C(=O)O)O

InChI

InChI=1S/C9H5N3O5S/c13-6-2-1-4(12(16)17)3-5(6)7-8(9(14)15)11-18-10-7/h1-3,13H,(H,14,15)