(4E)-2-nitro-4-[3-(1-oxidanidylpyridin-1-ium-3-yl)-2H-1,2,4-oxadiazol-5-ylidene]-6-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-nitro-4-[3-(1-oxidanidylpyridin-1-ium-3-yl)-2H-1,2,4-oxadiazol-5-ylidene]-6-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-hydroxy-6-nitro-4-[3-(1-oxidopyridin-1-ium-3-yl)-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-hydroxy-6-nitro-4-[3-(1-oxido-3-pyridin-1-iumyl)-2H-1,2,4-oxadiazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-hydroxy-6-nitro-4-[3-(1-oxidopyridin-1-ium-3-yl)-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-hydroxy-6-nitro-4-[3-(1-oxidopyridin-1-ium-3-yl)-2H-1,2,4-oxadiazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C13H8N4O6 MolecularWeight: 316.22582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)[O-])C2=NC(=C3C=C(C(=O)C(=C3)O)[N+](=O)[O-])ON2

Isomeric SMILES

C1=CC(=C[N+](=C1)[O-])C2=N/C(=C\3/C=C(C(=O)C(=C3)O)[N+](=O)[O-])/ON2

InChI

InChI=1S/C13H8N4O6/c18-10-5-8(4-9(11(10)19)17(21)22)13-14-12(15-23-13)7-2-1-3-16(20)6-7/h1-6,18H,(H,14,15)/b13-8+