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

Systemtic Name: 2-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1,2,3-triazol-4-yl]carbonylhydrazinylidene]methyl]-4-chloranyl-phenolate Openeye Name: 2-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)triazole-4-carbonyl]hydrazono]methyl]-4-chloro-phenolate CAS Name: 2-[(E)-[[[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-4-triazolyl]-oxomethyl]hydrazinylidene]methyl]-4-chlorophenolate IUPAC Name: 2-[(E)-[[1-(4-azaniumyl-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)triazole-4-carbonyl]hydrazinylidene]methyl]-4-chlorophenolate Traditional Name: 2-[(E)-[[1-(4-ammoniofurazan-3-yl)-5-p-phenetyl-triazole-4-carbonyl]hydrazono]methyl]-4-chloro-phenolate Formula: C20H17ClN8O4 MolecularWeight: 468.85318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)NN=CC4=C(C=CC(=C4)Cl)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3[NH3+])C(=O)N/N=C/C4=C(C=CC(=C4)Cl)[O-]

InChI

InChI=1S/C20H17ClN8O4/c1-2-32-14-6-3-11(4-7-14)17-16(24-28-29(17)19-18(22)26-33-27-19)20(31)25-23-10-12-9-13(21)5-8-15(12)30/h3-10,30H,2H2,1H3,(H2,22,26)(H,25,31)/b23-10+