(1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; sulfuric acid

Systemtic Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; sulfuric acid Openeye Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; sulfuric acid CAS Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenylazanide; sulfuric acid IUPAC Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenylazanide; sulfuric acid Traditional Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; sulfuric acid Formula: C20H18N4O4S MolecularWeight: 410.44632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N-]C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.OS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[N-]C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.OS(=O)(=O)O

InChI

InChI=1S/C20H16N4.H2O4S/c1-4-10-17(11-5-1)21-20-22-24(19-14-8-3-9-15-19)16-23(20)18-12-6-2-7-13-18;1-5(2,3)4/h1-16H;(H2,1,2,3,4)