4-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1,2,3-triazol-4-yl]carbonylhydrazinylidene]methyl]phenolate

Systemtic Name: 4-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1,2,3-triazol-4-yl]carbonylhydrazinylidene]methyl]phenolate Openeye Name: 4-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(p-tolyl)triazole-4-carbonyl]hydrazono]methyl]phenolate CAS Name: 4-[(E)-[[[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-4-triazolyl]-oxomethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 4-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)triazole-4-carbonyl]hydrazinylidene]methyl]phenolate Traditional Name: 4-[(E)-[[1-(4-ammoniofurazan-3-yl)-5-(p-tolyl)triazole-4-carbonyl]hydrazono]methyl]phenolate Formula: C19H16N8O3 MolecularWeight: 404.38214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)NN=CC4=CC=C(C=C4)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)N/N=C/C4=CC=C(C=C4)[O-]

InChI

InChI=1S/C19H16N8O3/c1-11-2-6-13(7-3-11)16-15(22-26-27(16)18-17(20)24-30-25-18)19(29)23-21-10-12-4-8-14(28)9-5-12/h2-10,28H,1H3,(H2,20,24)(H,23,29)/b21-10+