6-[[2-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1,2,3-triazol-4-yl]carbonyl]hydrazinyl]methylidene]-3-oxidanylidene-cyclohexa-1,4-dien-1-olate

Systemtic Name: 6-[[2-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1,2,3-triazol-4-yl]carbonyl]hydrazinyl]methylidene]-3-oxidanylidene-cyclohexa-1,4-dien-1-olate Openeye Name: 6-[[2-[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)triazole-4-carbonyl]hydrazino]methylene]-3-oxo-cyclohexa-1,4-dien-1-olate CAS Name: 6-[[[[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-4-triazolyl]-oxomethyl]hydrazo]methylidene]-3-oxo-1-cyclohexa-1,4-dienolate IUPAC Name: 6-[[2-[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)triazole-4-carbonyl]hydrazinyl]methylidene]-3-oxocyclohexa-1,4-dien-1-olate Traditional Name: 6-[[N'-[1-(4-ammoniofurazan-3-yl)-5-(3-methoxyphenyl)triazole-4-carbonyl]hydrazino]methylene]-3-keto-cyclohexa-1,4-dien-1-olate Formula: C19H16N8O5 MolecularWeight: 436.38094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)NNC=C4C=CC(=O)C=C4[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)NNC=C4C=CC(=O)C=C4[O-]

InChI

InChI=1S/C19H16N8O5/c1-31-13-4-2-3-10(7-13)16-15(22-26-27(16)18-17(20)24-32-25-18)19(30)23-21-9-11-5-6-12(28)8-14(11)29/h2-9,21,29H,1H3,(H2,20,24)(H,23,30)